data_1zxh_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 1zxh _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 ' 3' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 87.7 m-85 . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.618 0.246 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.611 HG11 ' H ' ' A' ' 16' ' ' THR . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.763 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.556 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.615 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.763 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.611 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.502 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.481 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HD2' ' N ' ' A' ' 19' ' ' LYS . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.47 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.481 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.571 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.753 ' O ' HG23 ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.434 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.481 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.608 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.556 ' O ' ' N ' ' A' ' 39' ' ' VAL . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.8 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.594 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.594 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.608 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.48 ' HB2' ' HG ' ' A' ' 17' ' ' LEU . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.509 HG11 ' H ' ' A' ' 16' ' ' THR . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.787 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.491 ' CZ ' ' OG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.787 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.509 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' HB2' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.481 ' O ' ' N ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.754 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.642 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.754 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.645 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.798 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.625 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.539 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.596 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.625 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.578 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.486 ' HG3' HG23 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.905 0.383 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.474 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 52' ' ' PHE . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.81 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.573 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.515 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.81 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.5 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.487 ' O ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.495 ' CG2' ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.458 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.623 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.814 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.513 ' O ' ' CG ' ' A' ' 32' ' ' GLN . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.635 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' VAL . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.813 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.614 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.585 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.813 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.573 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.455 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.5 m-85 . . . . . 0 CA--C 1.519 -0.229 0 CA-C-O 120.699 0.285 . . . . 0.0 110.56 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.504 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.612 HG11 ' H ' ' A' ' 16' ' ' THR . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.749 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.529 ' HE2' HD22 ' A' ' 34' ' ' LEU . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.749 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.612 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.504 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.466 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.533 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.533 ' CB ' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.756 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.431 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.756 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.623 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' A' ' 39' ' ' VAL . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.772 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.64 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.64 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.772 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.591 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.4 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 1.8 m-85 . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.448 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.79 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.518 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.497 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.79 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.457 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.531 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.459 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.552 ' O ' ' N ' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.802 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.641 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.812 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.628 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.559 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.595 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.628 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.812 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.423 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 . . . . . 0 N--CA 1.452 -0.353 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.499 ' CD2' ' HB3' ' A' ' 17' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 52' ' ' PHE . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 53' ' ' THR . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.512 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.679 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.497 ' H ' HG11 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB3' ' CD2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.484 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.446 ' CB ' ' HA ' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.463 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.738 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.646 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.679 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.562 ' O ' ' N ' ' A' ' 39' ' ' VAL . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.807 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.569 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.407 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.591 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.58 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.512 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.85 0.357 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 17' ' ' LEU . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.575 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.572 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.691 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.575 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.5 HG22 ' CE2' ' A' ' 14' ' ' TYR . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.492 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.512 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.455 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.429 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.754 ' O ' HG23 ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.605 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.754 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.691 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' N ' ' A' ' 39' ' ' VAL . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.816 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.632 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.632 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.573 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.529 ' HG3' HG23 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.581 ' HA ' ' CB ' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.551 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.514 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.694 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.581 ' CB ' ' HA ' ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.489 ' H ' HG11 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.467 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.474 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.462 ' HB1' ' CA ' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.455 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.595 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.746 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.424 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.609 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.746 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.694 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' VAL . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.789 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.612 ' CE2' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.612 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.578 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.056 -0.349 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.503 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.476 HG22 ' HG ' ' A' ' 34' ' ' LEU . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.791 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.606 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 55' ' ' GLN . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.501 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.791 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.465 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.503 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.452 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.552 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.543 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.767 ' O ' HG23 ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.618 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.767 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.637 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.621 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.567 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.597 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.768 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.606 HG11 ' OD1' ' A' ' 7' ' ' ASN . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HG3' HG23 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.641 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.565 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.572 ' HA ' ' CB ' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.601 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.709 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.504 ' H ' HG11 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.483 ' CG2' ' CD1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.452 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.439 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.467 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.622 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.759 ' O ' HG23 ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.423 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.467 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.622 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.759 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.709 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.798 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.595 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.587 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.533 ' CG2' ' HB2' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.595 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.606 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.466 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.517 ' O ' HD23 ' A' ' 17' ' ' LEU . 13.5 m-30 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.422 HD22 ' CB ' ' A' ' 17' ' ' LEU . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 52' ' ' PHE . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.802 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.562 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.472 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.802 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.519 ' H ' HG11 ' A' ' 5' ' ' VAL . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.477 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.448 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.459 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.6 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.755 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.655 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.538 ' O ' ' N ' ' A' ' 39' ' ' VAL . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.593 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.59 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.525 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.621 HG11 ' H ' ' A' ' 16' ' ' THR . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.749 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.603 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.605 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.749 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.621 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.469 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.444 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.417 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.56 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.432 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.605 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.63 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.584 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.566 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.63 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.764 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.607 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.486 ' HG3' HG23 ' A' ' 53' ' ' THR . 25.6 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.746 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.746 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.554 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.471 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.49 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.628 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.586 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.808 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.619 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.552 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.619 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.808 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.487 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 1.9 m-85 . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.528 HD13 ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.516 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.593 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.495 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.699 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.593 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.488 ' H ' HG11 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HB3' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.473 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.52 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.52 ' CB ' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.752 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.421 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.599 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.752 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.699 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.569 ' O ' ' N ' ' A' ' 39' ' ' VAL . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.797 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.634 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.584 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.578 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.634 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.797 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.582 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 50' ' ' LYS . 43.9 m-85 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.634 0.254 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.535 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.804 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.602 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.5 ' CE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.804 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.514 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.484 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.428 HG23 ' C ' ' A' ' 20' ' ' ALA . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.548 ' O ' ' N ' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.75 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.587 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.75 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.649 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.585 ' HA ' ' O ' ' A' ' 51' ' ' THR . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.763 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.524 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.408 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 17' ' ' LEU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.526 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.812 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.59 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.424 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.494 ' CE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.524 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.493 ' HB3' HD23 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.475 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.511 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.513 ' O ' ' N ' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.546 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.546 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.662 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 39' ' ' VAL . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.792 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.618 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.58 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.618 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.792 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.497 ' HG3' HG23 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.43 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 . . . . . 0 CA--C 1.52 -0.173 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.489 HD23 ' HB3' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.517 HG11 ' H ' ' A' ' 16' ' ' THR . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.493 ' CZ ' ' OG1' ' A' ' 16' ' ' THR . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.517 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HB3' HD23 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.472 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.515 ' CB ' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.77 ' O ' HG23 ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.504 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.486 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.63 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 39' ' ' VAL . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.494 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.774 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.606 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.567 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.606 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.774 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.6 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.402 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.574 HD13 ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.574 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 53' ' ' THR . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.617 ' HB2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.52 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.698 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.584 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.507 ' H ' HG11 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.482 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.451 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.412 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.455 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.627 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.743 ' O ' HG23 ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.438 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.743 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.698 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.583 ' O ' ' N ' ' A' ' 39' ' ' VAL . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.802 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.605 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.483 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.605 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.802 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.617 HG11 ' HB2' ' A' ' 7' ' ' ASN . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.446 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 1.6 m-85 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.76 0.314 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.527 HG11 ' H ' ' A' ' 16' ' ' THR . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.766 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.418 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.54 ' HE2' HD22 ' A' ' 34' ' ' LEU . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.766 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.527 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.445 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.594 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 31' ' ' ILE . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.594 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.608 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.825 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.63 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.541 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.551 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.63 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.825 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.564 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.542 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.585 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.573 ' O ' ' HA ' ' A' ' 53' ' ' THR . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.688 ' HE1' HD22 ' A' ' 34' ' ' LEU . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.55 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.523 ' H ' HG11 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.537 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.479 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.44 ' CB ' ' HA ' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.468 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.603 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.762 ' O ' HG23 ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.428 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.762 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.688 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.551 ' O ' ' N ' ' A' ' 39' ' ' VAL . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.464 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.604 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.542 ' CG2' ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.604 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.791 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.599 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.461 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.634 0.254 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.547 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -87.51 97.95 11.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 0.0 110.261 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 87.7 m-85 -123.9 151.86 43.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.65 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.611 HG11 ' H ' ' A' ' 16' ' ' THR . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.763 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.556 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.615 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.763 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.611 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.502 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.481 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.47 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.47 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.481 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.571 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.753 ' O ' HG23 ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.434 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.481 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.608 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.556 ' O ' ' N ' ' A' ' 39' ' ' VAL . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.8 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.594 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.594 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.608 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.469 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.465 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 1.7 tpt . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.979 0.419 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.69 65.82 9.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.525 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -122.09 150.95 41.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.48 ' HB2' ' HG ' ' A' ' 17' ' ' LEU . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.509 HG11 ' H ' ' A' ' 16' ' ' THR . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.787 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.491 ' CZ ' ' OG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.787 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.509 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' HB2' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 1' ' ' MET . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.481 ' O ' ' N ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.754 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.642 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.754 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.645 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.798 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.625 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.539 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.596 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.625 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.578 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.486 ' HG3' HG23 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.429 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.748 0.309 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.554 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.6 OUTLIER -79.76 78.81 6.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.067 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 -107.77 151.96 25.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.897 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.474 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 52' ' ' PHE . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.81 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.573 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.515 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.81 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.5 ' HB ' ' CE1' ' A' ' 14' ' ' TYR . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.487 ' O ' ' CD2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.495 ' CG2' ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.488 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.458 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.623 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.814 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.513 ' O ' ' CG ' ' A' ' 32' ' ' GLN . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.635 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' VAL . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.813 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.614 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.585 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.614 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.813 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.573 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttp . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.468 ' CG ' ' O ' ' A' ' 2' ' ' TYR . 0.2 OUTLIER -161.3 82.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.718 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.455 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.5 m-85 -121.27 151.07 40.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.56 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.504 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.612 HG11 ' H ' ' A' ' 16' ' ' THR . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.749 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.529 ' HE2' HD22 ' A' ' 34' ' ' LEU . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.749 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.612 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.504 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.466 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.533 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.533 ' CB ' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.756 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.431 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.756 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.623 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' A' ' 39' ' ' VAL . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.772 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.64 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.64 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.772 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.591 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.4 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.033 0.444 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -149.25 73.98 1.22 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.454 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 1.8 m-85 -115.94 150.89 36.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.208 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.448 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.79 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.518 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.497 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.79 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.457 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.459 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.552 ' O ' ' N ' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.802 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.641 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.812 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.628 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.559 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.595 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.628 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.812 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.549 0.214 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.06 104.9 16.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.234 0.54 . . . . 0.0 110.536 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.423 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 -125.44 151.58 46.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.151 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.499 ' CD2' ' HB3' ' A' ' 17' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 52' ' ' PHE . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.587 ' O ' ' HA ' ' A' ' 53' ' ' THR . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.512 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.679 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.55 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.497 ' H ' HG11 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB3' ' CD2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.484 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.446 ' CB ' ' HA ' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.463 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.738 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.646 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.679 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.562 ' O ' ' N ' ' A' ' 39' ' ' VAL . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.807 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.569 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.407 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.591 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.58 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.512 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.485 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.654 0.264 . . . . 0.0 111.271 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -66.19 67.79 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -126.11 150.86 47.92 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.652 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 17' ' ' LEU . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.575 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.572 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.691 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.575 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.5 HG22 ' CE2' ' A' ' 14' ' ' TYR . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.492 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 1' ' ' MET . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.512 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.455 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.429 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.464 ' O ' ' N ' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.754 ' O ' HG23 ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.422 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.605 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.754 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.691 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' O ' ' N ' ' A' ' 39' ' ' VAL . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.816 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.632 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.632 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.573 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.529 ' HG3' HG23 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.407 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.766 0.317 . . . . 0.0 111.105 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -75.12 90.16 2.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.604 179.893 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 -105.43 151.51 24.15 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.039 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.581 ' HA ' ' CB ' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.551 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.514 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.694 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.581 ' CB ' ' HA ' ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.489 ' H ' HG11 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.467 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.474 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 2' ' ' TYR . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.462 ' HB1' ' CA ' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.455 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.595 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.746 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.424 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.609 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.746 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.694 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' VAL . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.789 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.612 ' CE2' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.612 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.578 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.514 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.897 0.38 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.435 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.1 OUTLIER -153.01 76.76 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.467 179.785 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -113.7 151.23 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.056 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.503 HD13 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.476 HG22 ' HG ' ' A' ' 34' ' ' LEU . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.791 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.606 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 55' ' ' GLN . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.501 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.791 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.465 ' HB ' ' CZ ' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.503 ' CB ' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.452 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.552 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.543 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.767 ' O ' HG23 ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.618 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.767 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.637 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.768 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.621 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.567 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.597 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.768 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.606 HG11 ' OD1' ' A' ' 7' ' ' ASN . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HG3' HG23 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.654 0.264 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.458 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 1.4 m-85 -76.26 87.23 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.194 0.521 . . . . 0.0 110.237 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 -102.11 151.5 22.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.327 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.641 ' HA ' ' HB3' ' A' ' 17' ' ' LEU . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.565 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.572 ' HA ' ' CB ' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.601 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.709 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.504 ' H ' HG11 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.483 ' CG2' ' CD1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.452 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.439 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.467 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.622 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.759 ' O ' HG23 ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.423 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.467 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.622 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.759 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.709 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.512 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.798 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.595 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.587 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.533 ' CG2' ' HB2' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.595 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.606 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.466 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.413 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.782 0.325 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.414 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -83.25 88.75 6.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.126 0.489 . . . . 0.0 110.588 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.517 ' O ' HD23 ' A' ' 17' ' ' LEU . 13.5 m-30 -110.38 149.41 30.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.887 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.422 HD22 ' CB ' ' A' ' 17' ' ' LEU . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 52' ' ' PHE . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.802 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.562 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.54 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.472 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.802 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.519 ' H ' HG11 ' A' ' 5' ' ' VAL . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.477 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.448 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.438 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.459 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.6 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.755 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.755 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.655 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.538 ' O ' ' N ' ' A' ' 39' ' ' VAL . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.593 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.59 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.661 0.267 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.477 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -80.27 82.27 6.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.365 0.602 . . . . 0.0 110.559 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 -110.62 151.73 27.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.728 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.525 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.621 HG11 ' H ' ' A' ' 16' ' ' THR . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.749 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.603 ' OD1' HG11 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.605 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.749 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.621 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.469 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.477 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.444 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.417 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.56 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.432 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.605 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.764 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.63 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.584 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.566 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.63 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.764 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.607 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.486 ' HG3' HG23 ' A' ' 53' ' ' THR . 25.6 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.486 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 2.6 mtt . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.725 0.298 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -65.83 69.0 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.655 -179.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 1' ' ' MET . 6.0 m-85 -130.36 149.77 51.89 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.746 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.49 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.746 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.554 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.471 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 1' ' ' MET . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.49 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.415 ' HA ' ' CG ' ' A' ' 1' ' ' MET . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.519 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.628 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.586 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.808 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.619 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.552 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.619 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.808 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.914 0.387 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -161.7 80.17 0.57 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.598 -179.686 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.487 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 1.9 m-85 -116.47 150.92 37.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.25 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.528 HD13 ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.516 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.593 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.495 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.699 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.593 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.488 ' H ' HG11 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HB3' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.473 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.52 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.52 ' CB ' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.752 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.421 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.527 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.599 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.752 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.699 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.569 ' O ' ' N ' ' A' ' 39' ' ' VAL . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.797 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.634 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.584 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.578 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.634 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.797 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.582 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.429 ' CD1' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -110.76 115.99 30.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.974 0.416 . . . . 0.0 110.654 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 50' ' ' LYS . 43.9 m-85 -131.51 151.87 51.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.448 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.535 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.804 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.602 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.5 ' CE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.804 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.514 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.484 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HD2' ' CD1' ' A' ' 2' ' ' TYR . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.428 HG23 ' C ' ' A' ' 20' ' ' ALA . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.548 ' O ' ' N ' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.75 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.548 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.587 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.75 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.649 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 31' ' ' ILE . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.585 ' HA ' ' O ' ' A' ' 51' ' ' THR . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.58 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.763 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.524 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.408 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HA ' ' N ' ' A' ' 20' ' ' ALA . 7.7 ttm . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.592 0.234 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -67.29 71.27 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 179.433 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -121.9 148.69 44.43 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 17' ' ' LEU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.526 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.812 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.59 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.424 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.494 ' CE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.524 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.493 ' HB3' HD23 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.475 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 1' ' ' MET . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.513 ' N ' ' HA ' ' A' ' 1' ' ' MET . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.513 ' O ' ' N ' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.546 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.757 ' O ' HG23 ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.546 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.757 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.662 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.47 ' O ' ' N ' ' A' ' 39' ' ' VAL . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.792 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.618 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.58 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.618 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.792 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 7' ' ' ASN . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.497 ' HG3' HG23 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.821 0.343 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.461 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 1.1 p90 -158.8 83.94 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.588 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.43 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 -119.19 151.07 39.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.489 HD23 ' HB3' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.517 HG11 ' H ' ' A' ' 16' ' ' THR . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.493 ' CZ ' ' OG1' ' A' ' 16' ' ' THR . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.517 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HB3' HD23 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.472 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.515 ' CB ' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.77 ' O ' HG23 ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.504 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.486 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.77 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.63 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 39' ' ' VAL . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.494 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.774 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.606 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.567 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.606 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.774 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.6 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.571 0.224 . . . . 0.0 110.876 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.464 ' CZ ' ' CG ' ' A' ' 19' ' ' LYS . 1.8 m-85 -85.74 99.05 11.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.213 0.53 . . . . 0.0 110.378 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.402 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 -115.9 151.94 34.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.126 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.574 HD13 ' HB3' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.574 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 53' ' ' THR . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.617 ' HB2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.52 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.698 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.584 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.507 ' H ' HG11 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.482 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.464 ' CG ' ' CZ ' ' A' ' 2' ' ' TYR . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.451 ' CB ' ' CB ' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.412 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.455 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.627 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.743 ' O ' HG23 ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.438 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.743 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.698 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.583 ' O ' ' N ' ' A' ' 39' ' ' VAL . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.802 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.605 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.483 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.605 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.802 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.617 HG11 ' HB2' ' A' ' 7' ' ' ASN . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.754 0.311 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -139.11 92.96 2.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.253 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.446 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 1.6 m-85 -113.9 151.42 32.24 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.647 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.527 HG11 ' H ' ' A' ' 16' ' ' THR . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.766 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.418 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.54 ' HE2' HD22 ' A' ' 34' ' ' LEU . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.766 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.527 ' H ' HG11 ' A' ' 5' ' ' VAL . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.445 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.452 ' O ' ' N ' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.594 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.764 ' O ' HG23 ' A' ' 31' ' ' ILE . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.452 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.594 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.608 ' HG ' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 39' ' ' VAL . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.825 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.63 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.541 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.551 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.63 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.825 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.564 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.625 0.25 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.433 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -89.04 106.04 18.18 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.352 0.596 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 -128.91 152.02 49.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.723 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.542 ' HG ' ' CG2' ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.585 HG23 ' HB2' ' A' ' 52' ' ' PHE . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.573 ' O ' ' HA ' ' A' ' 53' ' ' THR . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.688 ' HE1' HD22 ' A' ' 34' ' ' LEU . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.55 ' HB3' ' HA ' ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.523 ' H ' HG11 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.537 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.479 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.44 ' CB ' ' HA ' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.468 ' O ' ' CB ' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.603 ' O ' ' HB3' ' A' ' 30' ' ' PHE . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.762 ' O ' HG23 ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.428 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.623 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.762 HG23 ' O ' ' A' ' 27' ' ' ARG . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.688 HD22 ' HE1' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.551 ' O ' ' N ' ' A' ' 39' ' ' VAL . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.464 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.604 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.542 ' CG2' ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.604 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.791 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.599 ' CG2' ' HB3' ' A' ' 43' ' ' TRP . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.461 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.838 ' C ' HD13 ' A' ' 4' ' ' LEU . 87.7 m-85 . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.618 0.246 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.97 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.782 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.794 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.629 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.493 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.97 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.74 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 19' ' ' LYS . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.74 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.815 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.036 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.843 ' N ' HD13 ' A' ' 34' ' ' LEU . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.592 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.891 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.642 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.642 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.795 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.036 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 51' ' ' THR . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.729 ' N ' HD13 ' A' ' 4' ' ' LEU . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.822 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.594 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.482 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.551 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.822 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.491 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.634 ' CB ' HD23 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.588 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.431 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.65 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.711 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.051 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.666 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.514 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.82 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.675 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.847 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.675 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.051 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.775 ' HG3' HG22 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.905 0.383 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.904 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.834 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.515 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 16' ' ' THR . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.834 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.624 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.619 HD13 ' H ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.534 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.801 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.654 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.653 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.842 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.124 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.828 ' N ' HD13 ' A' ' 34' ' ' LEU . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.589 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.842 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.663 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.758 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.663 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.806 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.124 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.685 ' HG3' HG22 ' A' ' 53' ' ' THR . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.589 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.885 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.5 m-85 . . . . . 0 CA--C 1.519 -0.229 0 CA-C-O 120.699 0.285 . . . . 0.0 110.56 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.803 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.612 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.473 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.776 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.941 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.646 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.759 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.603 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.646 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.792 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.018 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.695 ' N ' HD13 ' A' ' 34' ' ' LEU . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.602 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.875 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.689 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.556 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.884 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.018 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.485 ' CD ' HG22 ' A' ' 53' ' ' THR . 6.0 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.602 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.872 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.8 m-85 . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.902 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.684 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.809 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.585 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.809 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.585 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.902 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.533 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.701 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.679 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.701 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.495 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.667 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.854 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.159 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.785 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.588 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.854 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.678 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.678 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.159 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 . . . . . 0 N--CA 1.452 -0.353 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.671 HD13 ' C ' ' A' ' 4' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.806 HG21 ' CE3' ' A' ' 43' ' ' TRP . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' HB3' ' A' ' 15' ' ' GLU . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.595 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.475 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HB3' HG12 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.701 ' O ' HG12 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.859 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.827 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.855 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.057 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.885 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.584 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.616 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.607 HG22 ' HB3' ' A' ' 4' ' ' LEU . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.616 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.057 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.85 0.357 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.67 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.784 HG21 ' HE3' ' A' ' 43' ' ' TRP . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.731 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.512 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.731 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.512 ' O ' HG12 ' A' ' 5' ' ' VAL . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.571 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.494 HG12 ' OD1' ' A' ' 22' ' ' ASP . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.494 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.69 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 31' ' ' ILE . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.793 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.06 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.812 ' N ' HD13 ' A' ' 34' ' ' LEU . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.601 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.67 HG22 ' HG ' ' A' ' 4' ' ' LEU . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.06 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.749 ' HG3' HG22 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.601 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.902 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.902 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.758 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.571 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.657 ' O ' HG12 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.506 HD23 HD23 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.729 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.785 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.729 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.04 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.865 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.832 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.618 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.606 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.78 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.04 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.886 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.0 m-85 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.056 -0.349 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.912 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.695 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.807 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.699 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.555 ' HD2' HG21 ' A' ' 53' ' ' THR . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.545 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.807 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.545 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.912 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.505 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.962 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' A' ' 22' ' ' ASP . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.962 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.625 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.675 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.047 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.759 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.889 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.668 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.571 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.863 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.668 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.852 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.047 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.852 ' HG3' HG22 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.814 ' O ' HG22 ' A' ' 51' ' ' THR . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 16' ' ' THR . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.779 HG12 ' HB3' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.682 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.478 ' CZ ' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.779 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.87 ' O ' HG12 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.776 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.831 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.445 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.454 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.49 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.831 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.818 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.079 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.888 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.55 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.885 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.079 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.507 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 13.5 m-30 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.757 ' O ' HG22 ' A' ' 51' ' ' THR . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.755 HG21 ' HE3' ' A' ' 43' ' ' TRP . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.835 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.466 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.949 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.741 ' N ' HD22 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.853 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.853 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.446 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.629 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.839 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.072 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.784 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.614 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.839 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.638 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.757 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.638 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.072 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.567 ' HG3' HG22 ' A' ' 53' ' ' THR . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.88 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.781 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.688 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.525 ' HH ' ' HG1' ' A' ' 16' ' ' THR . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.525 ' HG1' ' HH ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.816 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.732 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.646 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.449 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.475 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.732 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.781 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.838 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.894 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.68 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.88 HG22 ' HG ' ' A' ' 4' ' ' LEU . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.789 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.789 ' HG3' HG22 ' A' ' 53' ' ' THR . 7.2 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.857 ' O ' HG22 ' A' ' 51' ' ' THR . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.754 HG21 ' HE3' ' A' ' 43' ' ' TRP . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.774 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.481 ' CZ ' ' CB ' ' A' ' 37' ' ' ASP . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.774 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.658 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.801 HD12 ' CB ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.638 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.661 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.635 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.745 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.09 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.728 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.818 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.67 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.09 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.837 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.9 m-85 . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.871 ' O ' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.753 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.733 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.536 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.733 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.856 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.652 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.704 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.45 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.652 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.84 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.086 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.872 ' N ' HD13 ' A' ' 34' ' ' LEU . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.84 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.684 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.871 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.684 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.793 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.086 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.446 ' CD2' ' HB3' ' A' ' 50' ' ' LYS . 43.9 m-85 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.634 0.254 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.944 ' HG ' HG22 ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.742 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.838 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.622 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.561 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.838 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.579 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.909 HD12 ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.799 HG22 ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.641 ' CG2' HG21 ' A' ' 25' ' ' THR . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.657 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.625 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.438 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.799 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.74 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.085 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.677 ' N ' HD13 ' A' ' 34' ' ' LEU . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.623 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.85 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.631 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.944 HG22 ' HG ' ' A' ' 4' ' ' LEU . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.631 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.757 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.085 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.562 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.623 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 15' ' ' GLU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.75 ' H ' HD22 ' A' ' 4' ' ' LEU . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.848 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.431 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.563 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.439 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.839 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.653 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.626 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.747 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' ILE . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.653 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.817 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.645 ' N ' HD13 ' A' ' 34' ' ' LEU . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.507 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.828 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.669 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.669 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.781 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.657 ' HG3' HG22 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 . . . . . 0 CA--C 1.52 -0.173 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.908 HD21 ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.832 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.518 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.908 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.493 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.872 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.719 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.659 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.863 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.469 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.719 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.8 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.688 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.593 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.888 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.755 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.765 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.025 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.754 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.81 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.741 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HB3' ' O ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.552 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.746 ' O ' HG12 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.81 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.715 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.875 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.875 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.715 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.912 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.109 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.921 ' N ' HD13 ' A' ' 34' ' ' LEU . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.587 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.912 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.656 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.807 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.804 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.109 HG21 HD11 ' A' ' 34' ' ' LEU . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.574 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.803 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.6 m-85 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.76 0.314 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.952 HD12 ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.773 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.504 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.502 ' O ' ' HZ ' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.952 ' HB2' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.476 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 1.006 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.602 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 1.006 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 31' ' ' ILE . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.726 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.044 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.761 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.611 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.819 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.544 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.819 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.044 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.95 ' HG ' HG22 ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.789 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.747 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.421 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.49 ' CE2' HG23 ' A' ' 16' ' ' THR . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.747 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.577 ' O ' HG12 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.808 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.857 HG22 ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.868 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.668 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.868 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.467 ' O ' HG22 ' A' ' 31' ' ' ILE . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.857 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.843 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.05 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.849 ' N ' HD13 ' A' ' 34' ' ' LEU . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.569 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.845 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.95 HG22 ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.787 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.465 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.634 0.254 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.547 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -87.51 97.95 11.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 0.0 110.261 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.838 ' C ' HD13 ' A' ' 4' ' ' LEU . 87.7 m-85 -123.9 151.86 43.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.65 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.97 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.782 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.794 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.629 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.493 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.97 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.74 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.74 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.815 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.036 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.843 ' N ' HD13 ' A' ' 34' ' ' LEU . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.592 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.891 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.642 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.642 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.795 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.036 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.471 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 1.7 tpt . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.979 0.419 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.69 65.82 9.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.525 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -122.09 150.95 41.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 51' ' ' THR . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.729 ' N ' HD13 ' A' ' 4' ' ' LEU . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.822 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.594 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.482 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.551 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.822 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.491 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.634 ' CB ' HD23 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 1' ' ' MET . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.588 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.431 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.65 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.711 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.051 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.666 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.514 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.82 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.675 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.847 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.675 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.051 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.775 ' HG3' HG22 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.429 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.748 0.309 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.554 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.6 OUTLIER -79.76 78.81 6.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.067 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 -107.77 151.96 25.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.897 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.904 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.834 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.515 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 16' ' ' THR . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.834 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.624 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.619 HD13 ' H ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.534 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.491 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.801 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.654 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.653 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.842 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.124 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.828 ' N ' HD13 ' A' ' 34' ' ' LEU . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.589 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.842 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.663 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.758 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.663 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.806 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.124 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.685 ' HG3' HG22 ' A' ' 53' ' ' THR . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.589 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.401 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 2.9 ttp . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.468 ' CG ' ' O ' ' A' ' 2' ' ' TYR . 0.2 OUTLIER -161.3 82.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.718 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.885 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.5 m-85 -121.27 151.07 40.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.56 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.803 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.612 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.473 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.776 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.941 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.646 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.759 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.401 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.603 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.646 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.792 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.018 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.695 ' N ' HD13 ' A' ' 34' ' ' LEU . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.602 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.875 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.689 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.556 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.884 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.018 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.485 ' CD ' HG22 ' A' ' 53' ' ' THR . 6.0 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.602 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.033 0.444 . . . . 0.0 110.923 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -149.25 73.98 1.22 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.454 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.872 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.8 m-85 -115.94 150.89 36.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.208 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.902 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.684 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.809 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.585 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.809 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.585 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.902 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.533 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.701 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.434 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.679 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.701 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.495 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.667 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.854 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.159 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.785 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.588 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.854 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.678 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.678 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.159 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.549 0.214 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -86.06 104.9 16.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.234 0.54 . . . . 0.0 110.536 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 -125.44 151.58 46.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.151 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.671 HD13 ' C ' ' A' ' 4' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.806 HG21 ' CE3' ' A' ' 43' ' ' TRP . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' HB3' ' A' ' 15' ' ' GLU . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.595 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.475 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HB3' HG12 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.701 ' O ' HG12 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.859 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.827 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HD1' ' A' ' 2' ' ' TYR . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.855 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.057 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.885 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.584 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.616 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.607 HG22 ' HB3' ' A' ' 4' ' ' LEU . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.616 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.057 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.486 ' HA ' ' N ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.654 0.264 . . . . 0.0 111.271 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.448 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -66.19 67.79 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -126.11 150.86 47.92 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.652 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.67 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.784 HG21 ' HE3' ' A' ' 43' ' ' TRP . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.731 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.512 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.731 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.512 ' O ' HG12 ' A' ' 5' ' ' VAL . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.571 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 1' ' ' MET . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.494 HG12 ' OD1' ' A' ' 22' ' ' ASP . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.494 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.69 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 31' ' ' ILE . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.793 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.06 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.812 ' N ' HD13 ' A' ' 34' ' ' LEU . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.601 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.67 HG22 ' HG ' ' A' ' 4' ' ' LEU . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.06 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.749 ' HG3' HG22 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.601 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.407 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.766 0.317 . . . . 0.0 111.105 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -75.12 90.16 2.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.604 179.893 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 -105.43 151.51 24.15 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.039 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.902 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.902 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.758 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.571 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.657 ' O ' HG12 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.506 HD23 HD23 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.729 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 2' ' ' TYR . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.785 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.729 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.04 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.865 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.832 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.618 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.606 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.78 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.04 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.547 ' H2 ' ' HB3' ' A' ' 20' ' ' ALA . 3.0 ttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.897 0.38 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.435 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.1 OUTLIER -153.01 76.76 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.467 179.785 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.886 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.0 m-85 -113.7 151.23 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.056 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.912 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.695 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.807 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.699 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.555 ' HD2' HG21 ' A' ' 53' ' ' THR . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.545 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.807 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.545 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.912 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.505 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.962 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' A' ' 22' ' ' ASP . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.962 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.625 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.675 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.047 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.759 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.889 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.668 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.571 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.863 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.668 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.852 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.047 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.852 ' HG3' HG22 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.425 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.654 0.264 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 1.4 m-85 -76.26 87.23 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.194 0.521 . . . . 0.0 110.237 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 -102.11 151.5 22.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.327 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.814 ' O ' HG22 ' A' ' 51' ' ' THR . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 16' ' ' THR . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.779 HG12 ' HB3' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.682 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.478 ' CZ ' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.779 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.87 ' O ' HG12 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.776 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.831 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.45 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.445 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.454 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.49 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.831 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.818 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.079 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.888 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.55 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.885 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.079 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.413 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.782 0.325 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.622 ' CG ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -83.25 88.75 6.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.126 0.489 . . . . 0.0 110.588 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.507 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 13.5 m-30 -110.38 149.41 30.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.887 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.757 ' O ' HG22 ' A' ' 51' ' ' THR . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.755 HG21 ' HE3' ' A' ' 43' ' ' TRP . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.835 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.466 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.949 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.741 ' N ' HD22 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HD1' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.853 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.853 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.446 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.629 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.839 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.072 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.784 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.614 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.839 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.638 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.757 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.638 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.072 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.567 ' HG3' HG22 ' A' ' 53' ' ' THR . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.661 0.267 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -80.27 82.27 6.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.365 0.602 . . . . 0.0 110.559 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 -110.62 151.73 27.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.728 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.88 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.781 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.688 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.525 ' HH ' ' HG1' ' A' ' 16' ' ' THR . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.525 ' HG1' ' HH ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.816 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.732 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.646 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.449 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.475 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.732 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.781 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.838 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.894 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.68 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.88 HG22 ' HG ' ' A' ' 4' ' ' LEU . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.789 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.789 ' HG3' HG22 ' A' ' 53' ' ' THR . 7.2 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 2.6 mtt . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.725 0.298 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -65.83 69.0 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.655 -179.812 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 1' ' ' MET . 6.0 m-85 -130.36 149.77 51.89 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.857 ' O ' HG22 ' A' ' 51' ' ' THR . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.754 HG21 ' HE3' ' A' ' 43' ' ' TRP . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.774 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.481 ' CZ ' ' CB ' ' A' ' 37' ' ' ASP . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.774 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.658 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.801 HD12 ' CB ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 1' ' ' MET . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 1' ' ' MET . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.638 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.661 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.635 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.745 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.09 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.728 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.818 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.67 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.09 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.914 0.387 . . . . 0.0 111.055 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -161.7 80.17 0.57 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.598 -179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.837 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.9 m-85 -116.47 150.92 37.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.25 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.871 ' O ' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.753 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.733 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.536 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.733 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.856 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.652 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.704 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.412 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.45 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.652 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.84 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.086 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.872 ' N ' HD13 ' A' ' 34' ' ' LEU . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.84 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.684 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.871 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.684 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.793 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.086 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.447 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.447 ' CD1' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -110.76 115.99 30.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.974 0.416 . . . . 0.0 110.654 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.447 ' CE1' ' HB3' ' A' ' 1' ' ' MET . 43.9 m-85 -131.51 151.87 51.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.448 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.944 ' HG ' HG22 ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.742 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.838 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.622 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.561 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.838 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.579 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.909 HD12 ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.799 HG22 ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' HD2' ' CD1' ' A' ' 2' ' ' TYR . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.641 ' CG2' HG21 ' A' ' 25' ' ' THR . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.657 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.625 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.438 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.799 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.74 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.085 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.677 ' N ' HD13 ' A' ' 34' ' ' LEU . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.623 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.85 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.631 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.944 HG22 ' HG ' ' A' ' 4' ' ' LEU . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.631 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.757 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.085 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.562 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.623 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.524 ' HA ' ' N ' ' A' ' 20' ' ' ALA . 7.7 ttm . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.592 0.234 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -67.29 71.27 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 179.433 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -121.9 148.69 44.43 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 15' ' ' GLU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.75 ' H ' HD22 ' A' ' 4' ' ' LEU . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.848 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.431 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.563 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.439 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.839 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.653 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 1' ' ' MET . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.626 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.747 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' ILE . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.653 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.817 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.645 ' N ' HD13 ' A' ' 34' ' ' LEU . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.507 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.828 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.669 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.669 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.781 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.657 ' HG3' HG22 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.443 ' H2 ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.821 0.343 . . . . 0.0 110.982 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.461 ' CD1' ' N ' ' A' ' 2' ' ' TYR . 1.1 p90 -158.8 83.94 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.588 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 -119.19 151.07 39.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.908 HD21 ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.832 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.518 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.908 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.493 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.872 ' O ' HD22 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.719 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.659 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.863 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.469 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.719 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.8 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.688 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.593 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.888 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.755 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.765 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.025 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.571 0.224 . . . . 0.0 110.876 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.464 ' CZ ' ' CG ' ' A' ' 19' ' ' LYS . 1.8 m-85 -85.74 99.05 11.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.213 0.53 . . . . 0.0 110.378 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.754 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 -115.9 151.94 34.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.126 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.81 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.741 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HB3' ' O ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.552 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.746 ' O ' HG12 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.81 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.715 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.464 ' CG ' ' CZ ' ' A' ' 2' ' ' TYR . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.875 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.875 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.715 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.912 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.109 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.921 ' N ' HD13 ' A' ' 34' ' ' LEU . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.587 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.912 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.656 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.807 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.804 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.109 HG21 HD11 ' A' ' 34' ' ' LEU . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.574 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.422 ' O ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.754 0.311 . . . . 0.0 111.127 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -139.11 92.96 2.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.253 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.803 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.6 m-85 -113.9 151.42 32.24 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.647 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.952 HD12 ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.773 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.504 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.502 ' O ' ' HZ ' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.952 ' HB2' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.476 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 1.006 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.602 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 1.006 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 31' ' ' ILE . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.726 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.044 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.761 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.611 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.819 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.544 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.819 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.044 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.625 0.25 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -89.04 106.04 18.18 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.352 0.596 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 -128.91 152.02 49.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.723 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.95 ' HG ' HG22 ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.789 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.747 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.421 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.49 ' CE2' HG23 ' A' ' 16' ' ' THR . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.747 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.577 ' O ' HG12 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.808 ' N ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.857 HG22 ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.868 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.668 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.868 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.467 ' O ' HG22 ' A' ' 31' ' ' ILE . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.857 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.843 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.05 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.849 ' N ' HD13 ' A' ' 34' ' ' LEU . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.569 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.845 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.95 HG22 ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.787 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.465 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.838 ' C ' HD13 ' A' ' 4' ' ' LEU . 87.7 m-85 . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.618 0.246 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.97 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.782 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.794 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.629 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.493 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.97 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.74 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 19' ' ' LYS . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.74 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.815 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.036 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.843 ' N ' HD13 ' A' ' 34' ' ' LEU . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.592 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.891 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.642 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.642 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.795 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.036 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 51' ' ' THR . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.729 ' N ' HD13 ' A' ' 4' ' ' LEU . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.822 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.594 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.482 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.551 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.822 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.491 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.634 ' CB ' HD23 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.588 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.431 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.65 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.711 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.051 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.666 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.514 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.82 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.675 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.847 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.675 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.051 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.775 ' HG3' HG22 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.905 0.383 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.904 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.834 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.515 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 16' ' ' THR . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.834 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.624 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.619 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.534 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.801 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.654 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.653 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.842 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.124 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.828 ' N ' HD13 ' A' ' 34' ' ' LEU . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.589 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.842 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.663 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.758 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.663 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.806 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.124 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.685 ' HG3' HG22 ' A' ' 53' ' ' THR . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.589 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.885 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.5 m-85 . . . . . 0 CA--C 1.519 -0.229 0 CA-C-O 120.699 0.285 . . . . 0.0 110.56 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.803 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.612 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.473 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.776 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.941 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.646 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.759 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.603 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.646 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.792 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.018 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.695 ' N ' HD13 ' A' ' 34' ' ' LEU . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.602 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.875 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.689 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.556 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.884 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.018 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.526 ' NE2' HG22 ' A' ' 53' ' ' THR . 1.4 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.602 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.872 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.8 m-85 . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.902 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.684 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.809 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.585 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.809 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.585 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.902 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.533 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.701 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.679 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.701 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.495 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.667 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.854 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.159 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.785 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.588 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.854 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.678 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.678 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.159 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 . . . . . 0 N--CA 1.452 -0.353 0 N-CA-C 110.151 -0.315 . . . . 0.0 110.151 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.806 HG21 ' CE3' ' A' ' 43' ' ' TRP . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' HB3' ' A' ' 15' ' ' GLU . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.595 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.475 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HB3' HG12 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.701 ' O ' HG12 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.859 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.827 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.855 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.057 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.885 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.584 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.616 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.607 HG22 ' HB3' ' A' ' 4' ' ' LEU . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.616 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.057 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.518 -0.27 0 CA-C-O 120.85 0.357 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.67 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.784 HG21 ' HE3' ' A' ' 43' ' ' TRP . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.731 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.512 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.731 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.512 ' O ' HG12 ' A' ' 5' ' ' VAL . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.571 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.494 HG12 ' OD1' ' A' ' 22' ' ' ASP . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.494 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.69 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 31' ' ' ILE . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.793 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.06 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.812 ' N ' HD13 ' A' ' 34' ' ' LEU . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.601 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.67 HG22 ' HG ' ' A' ' 4' ' ' LEU . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.06 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.749 ' HG3' HG22 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.601 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 . . . . . 0 N--CA 1.451 -0.381 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.902 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.902 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.758 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.571 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.657 ' O ' HG12 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.506 HD23 HD23 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.729 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.785 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.729 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.04 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.865 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.832 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.618 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.606 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.78 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.04 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.886 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.0 m-85 . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 110.056 -0.349 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.912 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.695 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.807 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.699 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.555 ' HD2' HG21 ' A' ' 53' ' ' THR . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.545 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.807 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.545 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.912 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.505 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.962 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' A' ' 22' ' ' ASP . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.962 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.625 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.675 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.047 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.759 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.889 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.668 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.571 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.863 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.668 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.852 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.047 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.852 ' HG3' HG22 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.814 ' O ' HG22 ' A' ' 51' ' ' THR . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 16' ' ' THR . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.779 HG12 ' HB3' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.682 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.478 ' CZ ' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.779 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.87 ' O ' HG12 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.776 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.831 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.445 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.454 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.49 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.831 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.818 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.079 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.888 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.55 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.885 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.079 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.507 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 13.5 m-30 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.757 ' O ' HG22 ' A' ' 51' ' ' THR . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.755 HG21 ' CE3' ' A' ' 43' ' ' TRP . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.835 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.466 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.949 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.741 ' N ' HD22 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.853 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.853 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.446 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.629 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.839 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.072 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.784 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.614 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.839 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.638 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.757 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.638 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.072 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.567 ' HG3' HG22 ' A' ' 53' ' ' THR . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.88 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.781 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.688 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.525 ' HH ' ' HG1' ' A' ' 16' ' ' THR . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.525 ' HG1' ' HH ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.732 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.646 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.449 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.475 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.732 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.781 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.838 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.894 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.68 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.88 HG22 ' HG ' ' A' ' 4' ' ' LEU . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.789 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.789 ' HG3' HG22 ' A' ' 53' ' ' THR . 25.6 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.857 ' O ' HG22 ' A' ' 51' ' ' THR . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.754 HG21 ' HE3' ' A' ' 43' ' ' TRP . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.774 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.481 ' CZ ' ' CB ' ' A' ' 37' ' ' ASP . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.774 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.658 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.801 HD12 ' CB ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.638 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.661 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.635 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.745 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.09 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.728 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.818 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.67 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.09 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.837 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.9 m-85 . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.871 ' O ' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.753 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.733 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.536 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.733 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.856 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.652 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.704 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.45 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.652 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.84 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.086 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.872 ' N ' HD13 ' A' ' 34' ' ' LEU . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.84 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.684 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.871 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.684 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.793 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.086 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.446 ' CD2' ' HB3' ' A' ' 50' ' ' LYS . 43.9 m-85 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.634 0.254 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.944 ' HG ' HG22 ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.742 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.838 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.622 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.561 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.838 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.579 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.909 HD12 ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.799 HG22 ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.641 ' CG2' HG21 ' A' ' 25' ' ' THR . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.657 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.625 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.438 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.799 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.74 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.085 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.677 ' N ' HD13 ' A' ' 34' ' ' LEU . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.623 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.85 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.631 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.944 HG22 ' HG ' ' A' ' 4' ' ' LEU . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.631 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.757 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.085 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.562 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.623 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 15' ' ' GLU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.75 ' H ' HD22 ' A' ' 4' ' ' LEU . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.848 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.431 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.563 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.439 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.839 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.653 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.626 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.747 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' ILE . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.653 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.817 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.645 ' N ' HD13 ' A' ' 34' ' ' LEU . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.507 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.828 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.669 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.669 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.781 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.657 ' HG3' HG22 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 . . . . . 0 CA--C 1.52 -0.173 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.908 HD21 ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.832 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.518 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.908 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.493 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.719 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.659 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.863 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.469 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.719 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.8 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.688 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.593 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.888 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.755 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.765 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.025 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.754 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.81 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.741 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HB3' ' O ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.552 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.746 ' O ' HG12 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.81 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.715 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.875 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.875 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.715 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.912 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.109 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.921 ' N ' HD13 ' A' ' 34' ' ' LEU . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.587 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.912 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.656 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.807 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.804 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.109 HG21 HD11 ' A' ' 34' ' ' LEU . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.574 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.803 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.6 m-85 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.76 0.314 . . . . 0.0 110.647 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.952 HD12 ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.773 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.504 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.502 ' O ' ' HZ ' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.952 ' HB2' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.476 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 1.006 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.602 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 1.006 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 31' ' ' ILE . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.726 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.044 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.761 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.611 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.819 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.544 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.819 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.044 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.95 ' HG ' HG22 ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.789 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.747 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.421 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.49 ' CE2' HG23 ' A' ' 16' ' ' THR . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.747 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.577 ' O ' HG12 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.808 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.857 HG22 ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.868 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.668 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.868 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.467 ' O ' HG22 ' A' ' 31' ' ' ILE . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.857 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.843 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.05 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.849 ' N ' HD13 ' A' ' 34' ' ' LEU . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.569 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.845 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.95 HG22 ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.787 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.465 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.634 0.254 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.547 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -87.51 97.95 11.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.038 0.447 . . . . 0.0 110.261 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.838 ' C ' HD13 ' A' ' 4' ' ' LEU . 87.7 m-85 -123.9 151.86 43.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.65 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.97 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -115.26 146.53 41.38 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.647 0.26 . . . . 0.0 110.737 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.782 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.5 p -126.2 145.84 33.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.115 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.794 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 11.9 m -134.79 114.56 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.994 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.629 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -84.0 131.55 34.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.083 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tppt? -137.64 114.46 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.975 0.417 . . . . 0.0 111.212 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.83 -119.99 2.5 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.7 -0.762 . . . . 0.0 111.92 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -118.3 -30.38 5.27 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 122.653 -0.322 . . . . 0.0 110.914 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -149.95 42.22 0.86 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.623 0.249 . . . . 0.0 111.09 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.6 121.5 0.83 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.876 0.369 . . . . 0.0 111.577 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -125.23 115.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.654 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -137.78 129.03 27.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.448 -179.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -134.27 135.0 42.56 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.255 0.55 . . . . 0.0 110.652 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.493 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.7 OUTLIER -138.7 147.04 42.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.506 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.97 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -123.21 117.34 25.1 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.999 179.023 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.74 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.37 152.78 48.74 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.144 0.497 . . . . 0.0 112.308 -179.051 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 6.9 mptt -69.22 125.43 26.66 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.854 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 7.94 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.5 t 68.22 -63.19 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER -124.84 -164.85 1.32 Allowed 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.27 0.557 . . . . 0.0 111.555 -179.351 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.1 -72.48 0.43 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.88 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.7 mp0 -56.33 -21.59 25.38 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.11 0.481 . . . . 0.0 110.539 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 20.8 m -72.84 -37.19 67.53 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.1 -21.98 49.64 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 176.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 13.3 tpt180 -77.75 -42.98 32.31 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.836 178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.1 t-20 -92.08 -48.52 6.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.276 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.36 -50.01 56.2 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.74 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.81 -49.92 66.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.584 -178.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.815 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.32 -34.11 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.7 mm-40 -68.3 -49.82 57.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 0.0 110.861 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 m -72.01 -42.74 66.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.612 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.036 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.31 -37.9 84.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.843 ' N ' HD13 ' A' ' 34' ' ' LEU . 3.7 mttm -77.96 -29.56 49.88 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 177.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -52.45 -27.18 15.03 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 178.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.32 -49.48 5.93 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.763 179.119 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.86 53.63 0.79 Allowed Glycine 0 C--N 1.332 0.346 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.379 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.556 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.59 -42.92 22.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.568 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -31.99 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.573 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.592 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.86 161.89 13.37 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.224 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.54 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.891 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.59 158.17 15.57 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.87 95.98 3.96 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 113.045 -1.889 . . . . 0.0 107.554 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.642 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -89.96 143.48 26.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.503 0.668 . . . . 0.0 112.673 -177.24 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.01 160.29 15.15 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.813 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.41 -35.53 12.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.55 78.22 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.15 -1.386 . . . . 0.0 110.137 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.3 p -100.15 -38.27 8.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.989 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 77.49 36.26 0.29 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.604 0.716 . . . . 0.0 109.905 -179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -138.25 141.57 39.91 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.385 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.642 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.83 150.09 27.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.361 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.795 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -124.64 100.53 6.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.475 -179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.036 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.54 93.8 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 121.688 0.756 . . . . 0.0 110.35 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.477 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.8 tt0 -105.24 131.25 52.95 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.444 -178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.228 -0.892 . . . . 0.0 111.044 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.471 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 1.7 tpt . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.979 0.419 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.69 65.82 9.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.525 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -122.09 150.95 41.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.053 0.454 . . . . 0.0 111.281 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 51' ' ' THR . 3.1 tm? -134.32 144.22 48.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.002 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.729 ' N ' HD13 ' A' ' 4' ' ' LEU . 3.5 p -123.44 146.75 28.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.363 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.822 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -136.55 114.61 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.518 0.675 . . . . 0.0 110.657 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.594 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.2 t-20 -87.38 129.77 34.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.435 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.482 ' HB3' ' HG2' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -137.04 115.24 11.66 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-O 121.188 0.518 . . . . 0.0 111.117 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.99 -124.02 2.84 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.841 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -112.59 -30.02 7.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.837 0.351 . . . . 0.0 110.944 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -151.1 44.62 0.81 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.692 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -168.22 126.69 1.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.038 0.447 . . . . 0.0 111.705 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -130.35 115.78 17.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.492 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.551 ' HE2' HD22 ' A' ' 34' ' ' LEU . 1.2 t80 -137.75 125.83 22.89 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.749 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.822 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.72 128.99 27.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.876 0.369 . . . . 0.0 110.996 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.491 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -139.64 135.24 33.06 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.634 ' CB ' HD23 ' A' ' 4' ' ' LEU . 0.2 OUTLIER -94.09 127.66 40.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.823 177.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.498 ' CG2' ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.52 153.16 48.75 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 1' ' ' MET . 6.2 tptt -76.37 97.26 4.2 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.318 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -95.31 9.92 38.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -177.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t 58.74 -70.0 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -114.58 -161.43 0.77 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.058 0.456 . . . . 0.0 111.551 -179.076 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.73 -73.09 0.49 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.715 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -57.9 -21.3 42.73 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.173 0.511 . . . . 0.0 110.31 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.588 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -72.06 -38.07 69.53 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -71.58 -21.99 61.79 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 176.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.431 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -82.56 -41.5 19.52 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.435 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 13.2 t-20 -90.9 -47.88 7.33 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 123.299 0.374 . . . . 0.0 111.929 -179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.54 -50.12 54.34 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.65 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -64.46 -50.36 67.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.76 -178.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.711 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -50.23 -33.37 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mt-30 -65.57 -49.88 67.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.08 0.467 . . . . 0.0 110.503 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 m -74.04 -41.87 61.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.359 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.051 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.55 -38.36 87.16 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.666 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.4 mttp -78.57 -28.97 45.97 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 177.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -58.36 -27.52 64.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.378 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.42 -49.64 5.83 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.947 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.81 53.5 0.76 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.557 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.1 -42.49 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -31.92 -30.35 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.514 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.36 162.21 13.11 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.258 -179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.28 135.54 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.82 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.4 159.55 14.85 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -177.417 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.64 97.49 4.38 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.049 -1.887 . . . . 0.0 107.521 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.675 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.56 147.19 23.83 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.637 0.732 . . . . 0.0 112.956 -176.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.94 161.9 13.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.979 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.29 -35.3 11.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.842 0.829 . . . . 0.0 108.854 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.42 -36.22 77.63 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.809 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.1 p -99.93 -38.76 8.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.255 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER 78.61 37.8 0.16 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.661 0.743 . . . . 0.0 109.69 -179.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.847 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.68 149.63 46.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.433 -178.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.675 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.61 148.12 43.71 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.939 179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 17.4 m -123.17 102.04 7.73 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.051 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.4 96.87 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 CA-C-O 121.599 0.714 . . . . 0.0 110.518 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.775 ' HG3' HG22 ' A' ' 53' ' ' THR . 3.8 mt-30 -106.58 127.81 53.63 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.074 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.429 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.748 0.309 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.554 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.6 OUTLIER -79.76 78.81 6.32 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.067 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.454 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 14.2 m-30 -107.77 151.96 25.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.897 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.904 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.7 OUTLIER -111.67 136.05 51.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.793 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 2.6 p -116.18 146.95 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 C-N-CA 120.406 -0.517 . . . . 0.0 111.956 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.834 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.4 m -137.19 114.36 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.564 0.697 . . . . 0.0 110.676 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.597 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.5 t30 -87.94 128.39 35.37 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.403 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.515 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -137.34 115.04 11.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.009 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -130.3 -122.29 2.4 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.255 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.14 -30.31 4.68 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 122.819 -0.224 . . . . 0.0 111.285 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -145.87 42.28 1.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.842 0.354 . . . . 0.0 111.358 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.42 122.19 0.16 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.158 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -138.17 115.6 11.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.482 . . . . 0.0 110.889 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 16' ' ' THR . 0.0 OUTLIER -137.95 133.98 34.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.399 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.834 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -136.28 117.67 14.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.125 0.488 . . . . 0.0 110.983 179.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.624 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.0 m -139.97 141.02 36.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.835 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.619 ' H ' HD13 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -102.32 134.72 45.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.676 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.534 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.86 152.61 47.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.036 0.446 . . . . 0.0 112.022 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.491 ' HG3' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -76.05 120.82 21.89 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.953 178.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.801 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.3 5.66 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.9 t 68.75 -65.07 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -116.66 -163.9 0.94 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 121.25 0.547 . . . . 0.0 111.834 -178.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.11 -73.02 0.49 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.783 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 11.5 mt-10 -56.82 -22.43 36.33 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.151 0.501 . . . . 0.0 110.56 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.654 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -73.59 -37.51 65.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.801 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.06 -21.68 54.06 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 176.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.91 -43.38 45.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.762 178.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -93.18 -48.16 6.6 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.5 -39.41 77.61 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.653 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -77.46 -48.55 16.87 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.94 -179.219 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.842 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -51.59 -34.43 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.682 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.6 pt20 -66.71 -51.05 60.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.289 0.566 . . . . 0.0 110.759 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 29.5 t -70.21 -42.8 71.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.473 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.124 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.13 -37.39 84.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.828 ' N ' HD13 ' A' ' 34' ' ' LEU . 5.2 mtmm -76.4 -30.23 57.41 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -52.47 -27.51 16.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.324 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -93.45 -49.41 5.93 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.84 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.03 53.65 0.78 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.1 -42.51 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -31.97 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.467 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.589 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.46 162.32 12.78 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.297 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.31 136.56 52.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.842 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -96.82 158.76 15.28 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -177.368 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.7 97.78 4.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.735 177.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.663 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.3 144.05 25.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.475 0.655 . . . . 0.0 112.615 -177.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.9 160.97 14.59 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.078 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -35.24 12.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.5 -37.27 77.84 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.945 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -101.58 -39.76 7.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.857 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 6.0 mttp 77.79 38.31 0.2 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.624 0.726 . . . . 0.0 109.75 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.758 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -137.81 137.8 38.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.263 -178.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.663 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.77 151.71 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.513 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.806 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 9.8 m -127.12 102.56 7.01 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.527 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.124 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.42 95.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.604 0.716 . . . . 0.0 110.608 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.685 ' HG3' HG22 ' A' ' 53' ' ' THR . 4.8 mt-30 -107.15 124.92 50.4 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.253 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.589 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.266 -0.873 . . . . 0.0 111.037 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.401 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 2.9 ttp . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.468 ' CG ' ' O ' ' A' ' 2' ' ' TYR . 0.2 OUTLIER -161.3 82.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.718 -179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.885 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.5 m-85 -121.27 151.07 40.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.56 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.941 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.55 142.81 49.72 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.328 -0.396 . . . . 0.0 109.968 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.803 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -126.45 145.82 33.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 119.792 -0.763 . . . . 0.0 112.132 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.776 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 13.3 m -135.5 114.61 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.608 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.612 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -85.93 133.37 33.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.437 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.7 tptt -136.77 114.85 11.52 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 120.331 -0.547 . . . . 0.0 111.07 178.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.09 -127.12 3.22 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.47 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -112.53 -30.2 7.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.81 0.338 . . . . 0.0 111.008 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -150.06 42.83 0.86 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.924 0.392 . . . . 0.0 111.539 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.66 125.58 1.22 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.919 0.39 . . . . 0.0 111.662 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -129.12 115.83 18.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.468 179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.473 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 2.3 t80 -137.97 131.45 30.81 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.776 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.57 136.16 37.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.079 0.466 . . . . 0.0 110.613 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.68 144.82 39.77 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.669 0.747 . . . . 0.0 111.873 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.941 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -124.43 112.0 16.4 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.127 178.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.646 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.42 152.72 48.62 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.041 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.5 mmmt -53.83 134.65 42.51 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.759 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.47 8.83 10.8 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.401 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.5 t 61.99 -67.51 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 120.591 0.234 . . . . 0.0 111.326 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 20' ' ' ALA . 10.7 m-20 -125.73 -159.75 0.92 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.824 0.345 . . . . 0.0 110.701 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.46 -71.38 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.615 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -59.13 -19.65 46.64 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.154 0.502 . . . . 0.0 110.163 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.603 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 28.3 m -71.87 -36.94 70.24 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 177.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -70.23 -23.68 62.96 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -81.87 -40.88 21.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.615 179.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.4 t-20 -92.35 -47.06 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.73 -50.56 49.67 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.646 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -66.87 -49.62 65.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.627 -178.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.792 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -47.18 -35.08 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.7 mt-30 -64.19 -49.88 70.3 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 0.0 110.558 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -74.98 -40.94 60.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.464 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.018 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.0 -38.85 87.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.695 ' N ' HD13 ' A' ' 34' ' ' LEU . 4.5 mttp -79.4 -29.02 41.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.888 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -55.88 -27.74 53.29 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.461 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -93.6 -49.53 5.84 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.844 179.203 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.44 53.58 0.78 Allowed Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.509 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -51.41 -42.54 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -31.95 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.602 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.94 162.1 13.28 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.591 -0.814 . . . . 0.0 113.51 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.1 p -116.51 135.59 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.875 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -96.59 158.6 15.36 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -177.541 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.0 m -130.7 97.1 4.26 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.11 -1.859 . . . . 0.0 106.635 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.689 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.78 147.65 22.85 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -105.1 161.68 14.03 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.895 178.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.91 -34.82 11.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.78 -36.89 80.12 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.334 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 14.1 p -99.91 -37.21 9.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.323 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.556 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 2.3 mttp 77.71 36.96 0.24 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.721 0.772 . . . . 0.0 110.093 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.884 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.75 149.6 46.58 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.023 -0.99 . . . . 0.0 111.418 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.25 150.79 38.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.852 178.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.766 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.6 m -124.65 101.24 7.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.018 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.72 95.67 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.117 0 CA-C-O 121.701 0.762 . . . . 0.0 110.626 -179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.526 ' NE2' HG22 ' A' ' 53' ' ' THR . 1.4 mt-30 -102.84 125.73 49.7 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.287 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.602 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.27 -0.871 . . . . 0.0 111.025 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.033 0.444 . . . . 0.0 110.923 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.462 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -149.25 73.98 1.22 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.454 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.872 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.8 m-85 -115.94 150.89 36.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.208 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.902 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.42 146.47 46.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.684 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -128.08 147.56 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.171 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.809 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.2 m -137.15 114.5 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.498 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -85.51 129.2 34.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.061 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.43 114.95 11.86 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.039 0.447 . . . . 0.0 111.421 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.19 -120.66 2.6 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.75 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -117.76 -30.2 5.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.816 0.341 . . . . 0.0 111.244 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -150.07 43.13 0.87 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.934 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 128.86 0.52 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.839 0.352 . . . . 0.0 111.324 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -133.03 122.22 23.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.822 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.585 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.2 t80 -137.64 118.44 14.14 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.94 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.809 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -126.71 119.55 27.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.15 0.5 . . . . 0.0 109.84 178.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.585 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.5 m -138.87 124.41 19.48 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.906 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.902 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -94.81 129.98 41.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.165 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.533 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.56 152.78 47.15 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.832 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -63.07 131.85 49.95 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.701 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.33 12.07 11.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.434 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.8 t 59.62 -69.42 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t0 -122.39 -159.4 0.83 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.888 0.375 . . . . 0.0 111.237 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -71.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.69 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.84 -20.4 35.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.314 0.578 . . . . 0.0 110.26 179.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.679 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.4 m -72.93 -37.1 67.29 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.701 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -72.15 -22.91 61.24 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.495 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -78.26 -45.04 23.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.946 178.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 3.9 m120 -93.21 -48.48 6.44 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.39 -40.52 85.68 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.667 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -77.55 -50.05 13.38 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.136 -179.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.854 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -50.16 -35.03 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' A' ' 29' ' ' ALA . 4.7 pt20 -65.37 -51.06 63.0 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.237 0.542 . . . . 0.0 110.739 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.7 m -71.83 -42.93 66.39 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.526 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.159 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.25 -37.46 83.18 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.004 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.785 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.44 -30.05 53.19 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.47 -28.21 53.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.345 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -49.57 5.85 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.806 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.35 0.8 Allowed Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.419 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.87 -42.19 32.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -31.85 -30.52 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.536 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.588 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.76 162.06 12.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.179 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.6 p -116.32 136.62 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.854 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.13 158.14 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.65 96.92 4.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.503 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.678 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.82 147.21 23.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -176.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.92 161.76 13.92 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.074 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.89 -35.81 11.88 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.86 0.838 . . . . 0.0 108.772 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -36.64 77.5 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.094 -1.412 . . . . 0.0 110.44 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.8 p -100.08 -37.88 8.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.056 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.4 mttt 77.91 36.82 0.24 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.584 0.707 . . . . 0.0 109.944 -179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.43 151.55 48.64 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.437 -178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.678 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.98 150.05 41.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.066 179.017 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.807 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -123.34 101.55 7.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.318 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.159 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.95 95.42 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 CA-C-O 121.669 0.747 . . . . 0.0 110.405 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.6 tt0 -105.14 130.63 53.27 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.205 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.094 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.549 0.214 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -86.06 104.9 16.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.234 0.54 . . . . 0.0 110.536 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 85.9 m-85 -125.44 151.58 46.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.151 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.2 tm? -111.92 140.54 46.5 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.806 HG21 ' CE3' ' A' ' 43' ' ' TRP . 4.1 p -125.24 145.62 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.597 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' HB3' ' A' ' 15' ' ' GLU . 9.5 m -133.36 114.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.376 0.608 . . . . 0.0 111.058 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.595 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.6 t-20 -83.26 124.58 30.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.844 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.3 mmtt -132.27 114.39 14.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.41 -123.67 2.73 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.297 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -117.99 -30.24 5.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.783 0.325 . . . . 0.0 111.093 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -146.91 43.59 1.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.938 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.94 127.6 0.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 0.0 111.482 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -134.4 115.4 13.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.888 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.475 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.16 130.24 28.65 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.961 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HB3' HG12 ' A' ' 6' ' ' VAL . 0.8 OUTLIER -137.73 124.22 20.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.065 0.459 . . . . 0.0 111.698 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.701 ' O ' HG12 ' A' ' 5' ' ' VAL . 62.7 p -139.04 152.0 47.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.833 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.859 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.29 126.61 46.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.103 178.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.827 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.7 t -138.7 152.54 48.1 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.826 0.346 . . . . 0.0 111.911 -179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HA ' ' HD1' ' A' ' 2' ' ' TYR . 0.1 OUTLIER -68.92 121.51 16.75 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.804 178.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.26 18.71 12.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.4 t 67.39 -68.8 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.291 -0.413 . . . . 0.0 112.0 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -121.95 -158.81 0.79 Allowed 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 111.387 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.12 -70.13 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.544 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 0.6 OUTLIER -57.0 -22.07 35.56 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.262 0.553 . . . . 0.0 110.447 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 25.6 m -72.96 -37.07 67.24 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.855 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.0 -21.74 50.39 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 176.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -75.77 -43.88 44.31 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.604 178.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 31' ' ' ILE . 5.0 t30 -92.04 -49.09 6.39 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.06 -50.16 56.89 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.827 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -65.79 -49.72 67.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.607 -179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.31 -34.28 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -71.68 -41.14 69.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.973 0.416 . . . . 0.0 110.841 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.3 t -77.71 -42.88 32.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.793 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.057 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.41 -36.42 83.67 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.09 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.885 ' N ' HD13 ' A' ' 34' ' ' LEU . 2.4 mtmm -76.82 -29.8 56.09 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -50.55 -27.2 6.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.167 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.2 -49.51 5.94 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 178.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.29 54.38 0.76 Allowed Glycine 0 C--N 1.333 0.416 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.341 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.562 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.28 -42.58 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -31.65 -30.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.451 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.584 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.71 162.13 13.01 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.519 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.5 136.12 54.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.8 158.35 15.54 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 -177.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.83 97.47 4.35 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.955 -1.929 . . . . 0.0 107.598 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.616 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.95 144.2 25.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.491 0.662 . . . . 0.0 112.785 -177.33 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.98 160.48 15.0 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.839 178.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.38 -35.38 12.39 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.17 75.57 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.399 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.5 p -101.39 -40.95 6.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.077 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.1 mtpp 80.29 37.4 0.11 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.622 0.725 . . . . 0.0 109.556 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.607 HG22 ' HB3' ' A' ' 4' ' ' LEU . 1.2 p -138.46 138.77 38.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.469 -179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.616 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -105.37 155.19 19.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.096 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.7 m -128.29 100.56 5.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.31 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.057 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -74.92 93.77 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.724 0.773 . . . . 0.0 110.405 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.522 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.5 tt0 -105.44 129.94 53.64 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.448 -178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.176 -0.916 . . . . 0.0 111.083 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.486 ' HA ' ' N ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.654 0.264 . . . . 0.0 111.271 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.448 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -66.19 67.79 0.05 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -126.11 150.86 47.92 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.652 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.67 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -135.88 146.44 47.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.187 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.784 HG21 ' HE3' ' A' ' 43' ' ' TRP . 5.2 p -126.64 145.27 34.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.735 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.731 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.6 m -133.46 114.92 21.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.299 0.571 . . . . 0.0 110.824 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 3.9 t-20 -85.65 130.73 34.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.246 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 3.7 tptp -137.81 115.34 11.23 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-O 121.179 0.514 . . . . 0.0 111.256 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 -123.02 2.68 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.664 -0.779 . . . . 0.0 111.963 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -116.72 -30.26 5.84 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.7 0.286 . . . . 0.0 111.042 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -147.95 43.54 1.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.68 0.276 . . . . 0.0 111.17 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.64 127.46 0.51 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.776 0.322 . . . . 0.0 111.545 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.415 ' CD1' ' N ' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -134.51 115.36 13.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.73 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.512 ' CE2' HG23 ' A' ' 16' ' ' THR . 0.3 OUTLIER -137.87 129.67 28.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.731 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.4 mt-10 -137.88 128.09 26.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.043 0.449 . . . . 0.0 111.342 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.512 ' O ' HG12 ' A' ' 5' ' ' VAL . 73.4 p -138.67 138.89 38.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.141 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 4' ' ' LEU . 1.2 pp -110.58 126.99 55.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.203 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.571 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.73 153.52 48.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 1' ' ' MET . 2.0 mmmt -72.61 93.05 1.57 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.425 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -86.98 14.37 7.51 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -178.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.494 HG12 ' OD1' ' A' ' 22' ' ' ASP . 20.4 t 62.4 -70.2 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.494 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -118.02 -161.62 0.84 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.49 -71.72 0.55 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.692 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -57.72 -21.75 42.6 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.194 0.521 . . . . 0.0 110.491 179.75 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.614 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.4 m -72.56 -37.73 68.16 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.69 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.2 -21.95 60.56 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 176.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.452 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 2.2 mmt180 -80.6 -41.79 23.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.231 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 31' ' ' ILE . 83.1 m-20 -91.66 -48.96 6.54 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.25 -49.9 57.54 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.2 -49.99 65.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.645 -178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.793 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.12 -34.61 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.422 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -67.51 -49.52 63.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.965 0.412 . . . . 0.0 110.875 -179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -73.56 -42.71 61.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.629 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.06 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.06 -38.86 84.07 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.812 ' N ' HD13 ' A' ' 34' ' ' LEU . 12.7 mttm -78.18 -29.45 48.55 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -52.4 -27.38 15.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -93.58 -49.49 5.86 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.887 179.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.96 53.58 0.79 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.602 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.532 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.68 -42.41 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -32.05 -30.27 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.674 -178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.601 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 162.12 13.06 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.222 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.55 135.4 56.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -94.36 160.06 14.84 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -177.394 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 98.17 4.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 113.103 -1.862 . . . . 0.0 107.284 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -95.73 149.01 21.96 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -176.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.71 161.96 13.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.87 178.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.67 -34.0 11.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.842 0.829 . . . . 0.0 109.123 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.82 79.24 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.298 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.3 p -99.83 -40.62 7.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.48 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.1 mttp 82.09 39.59 0.05 OUTLIER 'General case' 0 C--O 1.238 0.451 0 CA-C-O 122.057 0.932 . . . . 0.0 109.017 -178.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.67 HG22 ' HG ' ' A' ' 4' ' ' LEU . 78.9 p -137.82 154.89 49.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.475 -1.239 . . . . 0.0 111.751 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -126.32 152.87 45.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.049 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 6.8 m -126.83 102.14 6.9 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.06 HG21 HD11 ' A' ' 34' ' ' LEU . 1.6 t -75.15 96.5 1.1 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 CA-C-O 121.612 0.72 . . . . 0.0 110.763 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.749 ' HG3' HG22 ' A' ' 53' ' ' THR . 13.9 mt-30 -106.65 129.81 54.5 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.189 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.601 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.069 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.407 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.766 0.317 . . . . 0.0 111.105 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -75.12 90.16 2.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.604 179.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.537 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.0 m-30 -105.43 151.51 24.15 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.039 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.902 HD22 ' N ' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -112.23 135.84 52.39 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.902 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.7 p -121.65 145.37 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.091 -179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.758 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.9 m -133.91 114.52 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.976 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.571 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.1 t30 -84.11 129.1 34.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.084 -179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.5 tttt -137.98 114.55 10.45 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.09 0.471 . . . . 0.0 110.777 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -125.82 -121.3 2.49 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.471 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -118.81 -30.17 5.15 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.645 -0.327 . . . . 0.0 111.29 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -147.07 43.9 1.15 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.51 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -174.81 127.95 0.3 Allowed 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.83 0.347 . . . . 0.0 111.473 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.43 115.2 12.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.833 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.513 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -138.13 130.83 29.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.96 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.9 mt-10 -137.77 125.08 21.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 111.687 -179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.657 ' O ' HG12 ' A' ' 5' ' ' VAL . 82.5 p -138.9 151.34 46.86 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.628 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.506 HD23 HD23 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -123.89 124.25 42.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.927 178.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.729 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.1 t -138.19 152.35 48.57 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.48 ' HB2' ' CZ ' ' A' ' 2' ' ' TYR . 15.8 tptt -64.05 119.57 10.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.0 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.37 13.21 11.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.7 -71.78 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.407 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.21 -160.48 0.77 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 121.158 0.504 . . . . 0.0 111.625 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.75 -71.36 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.696 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 4.3 mm-40 -57.03 -22.25 37.42 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.095 0.474 . . . . 0.0 110.502 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.2 m -73.05 -37.42 66.86 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.785 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.98 -21.79 50.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 176.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.453 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -76.14 -43.42 43.02 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.784 178.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 31' ' ' ILE . 33.7 m-20 -92.33 -49.1 6.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.309 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.84 -49.94 59.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.729 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -67.12 -48.27 68.6 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -178.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.757 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.54 -34.3 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -69.13 -45.18 70.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.997 0.427 . . . . 0.0 110.89 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -75.62 -42.77 50.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.832 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.04 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.26 -37.59 86.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.087 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.865 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.9 mtmt -76.96 -29.83 55.75 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -50.71 -27.48 7.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.221 177.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -93.43 -49.4 5.94 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.735 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.9 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.494 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.83 -42.84 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -32.11 -30.45 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.215 0.606 . . . . 0.0 112.577 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.67 162.1 13.04 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.285 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.53 136.14 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.832 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -94.48 158.33 15.6 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 -177.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.69 97.58 4.4 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.521 177.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.96 144.93 24.78 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -177.17 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.73 13.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.889 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.5 -34.85 11.9 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.797 0.808 . . . . 0.0 108.989 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.05 -36.83 75.71 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.455 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.9 p -102.11 -39.89 7.07 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.796 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.618 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.3 mtpp 79.48 37.49 0.13 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.734 0.778 . . . . 0.0 109.953 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.606 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.84 144.14 41.31 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.337 -178.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.24 155.07 23.52 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.791 0.329 . . . . 0.0 110.208 178.601 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.78 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -127.69 101.17 6.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.244 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.04 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.02 94.18 0.86 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.144 0 CA-C-O 121.671 0.748 . . . . 0.0 110.423 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.525 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -106.8 130.08 54.56 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.307 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.973 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.547 ' H2 ' ' HB3' ' A' ' 20' ' ' ALA . 3.0 ttt . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.897 0.38 . . . . 0.0 110.872 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.435 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.1 OUTLIER -153.01 76.76 1.14 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.467 179.785 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.886 ' C ' HD13 ' A' ' 4' ' ' LEU . 2.0 m-85 -113.7 151.23 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.056 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.912 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -120.75 148.25 44.23 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.327 -179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.695 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.0 p -130.16 148.07 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.184 -0.606 . . . . 0.0 112.378 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.807 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 3.9 m -137.41 114.58 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.72 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.699 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.53 130.7 34.4 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.439 -179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.555 ' HD2' HG21 ' A' ' 53' ' ' THR . 2.1 mttm -137.91 114.97 10.85 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 121.109 0.48 . . . . 0.0 111.372 178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.98 -124.49 2.83 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.144 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.85 -30.34 6.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.759 0.314 . . . . 0.0 111.006 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -147.58 44.22 1.11 Allowed 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.19 127.49 0.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.0 111.622 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -131.82 115.76 16.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.538 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.545 ' HE1' ' HG1' ' A' ' 16' ' ' THR . 1.0 OUTLIER -137.88 121.73 17.65 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.824 0.345 . . . . 0.0 111.068 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.807 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -129.41 120.44 25.52 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.545 ' HG1' ' HE1' ' A' ' 14' ' ' TYR . 1.6 m -139.0 123.98 18.87 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.174 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.912 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -91.8 125.81 36.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.292 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.505 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -139.08 152.74 47.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.567 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -53.61 137.45 36.92 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.962 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.39 6.08 10.66 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG12 ' OD1' ' A' ' 22' ' ' ASP . 29.0 t 55.64 -74.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.553 ' OD1' HG12 ' A' ' 21' ' ' VAL . 7.8 m-20 -120.61 -158.33 0.75 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.813 0.34 . . . . 0.0 110.738 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.02 -19.22 61.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.297 0.57 . . . . 0.0 110.188 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 92.1 m -73.66 -36.92 65.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.962 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -70.26 -25.46 63.38 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 6.3 tpt180 -78.36 -44.19 25.69 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.518 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.441 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 2.9 m-80 -92.74 -46.94 7.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.23 -50.08 62.03 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.625 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -68.14 -50.06 57.07 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 -178.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.675 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.58 -34.38 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.73 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.1 mm-40 -66.49 -49.81 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 110.676 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.9 m -71.62 -42.73 67.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.411 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.047 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.88 -37.87 86.18 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.759 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.4 mttt -75.78 -30.16 59.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -54.76 -27.99 45.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.323 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.52 -49.53 5.86 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.979 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.21 53.63 0.77 Allowed Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.31 -42.97 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -32.45 -30.31 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.729 0.641 . . . . 0.0 112.729 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -109.04 161.99 12.95 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.485 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.45 136.65 52.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.889 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.03 159.37 14.95 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 115.319 1.599 . . . . 0.0 115.319 -177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.6 96.91 4.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 112.964 -1.926 . . . . 0.0 107.411 177.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.668 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.67 146.19 23.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.545 0.688 . . . . 0.0 112.756 -176.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.06 161.9 13.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.957 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.4 -34.88 11.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.06 79.34 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.513 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.3 p -100.11 -37.38 8.98 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.163 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.571 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 3.5 mmtp 77.72 36.93 0.24 Allowed 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.49 0.662 . . . . 0.0 109.915 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.863 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.56 152.67 49.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.487 -178.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.668 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.69 150.13 41.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.926 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.852 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.9 m -123.98 101.17 7.1 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.047 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.49 95.63 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.089 0 CA-C-O 121.671 0.748 . . . . 0.0 110.632 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.852 ' HG3' HG22 ' A' ' 53' ' ' THR . 32.6 mt-30 -105.56 130.18 53.67 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.129 -0.942 . . . . 0.0 111.246 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.029 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.425 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.654 0.264 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 1.4 m-85 -76.26 87.23 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.194 0.521 . . . . 0.0 110.237 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.53 ' CE2' ' CE2' ' A' ' 45' ' ' TYR . 8.1 m-30 -102.11 151.5 22.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.327 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.814 ' O ' HG22 ' A' ' 51' ' ' THR . 7.3 mp -106.21 130.35 54.09 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.818 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 16' ' ' THR . 2.5 p -121.29 142.17 38.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.309 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.779 HG12 ' HB3' ' A' ' 15' ' ' GLU . 13.7 m -135.35 114.62 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.16 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.682 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -82.74 129.4 34.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.845 179.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 69.5 tttt -136.49 114.38 11.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.011 0.434 . . . . 0.0 110.855 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.39 -121.44 2.59 Favored Glycine 0 C--N 1.32 -0.339 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.554 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.69 -30.06 5.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.36 . . . . 0.0 111.305 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -148.22 43.96 1.05 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.772 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -172.3 123.45 0.48 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.926 0.393 . . . . 0.0 111.619 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -128.91 115.42 17.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.723 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.478 ' CZ ' ' CG2' ' A' ' 16' ' ' THR . 0.2 OUTLIER -138.2 128.62 26.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.8 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.779 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.2 mp0 -137.47 124.71 21.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.231 0.538 . . . . 0.0 111.474 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.87 ' O ' HG12 ' A' ' 5' ' ' VAL . 71.1 p -138.34 151.28 47.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.262 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.776 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.46 126.22 44.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.592 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.831 HG22 ' CE1' ' A' ' 30' ' ' PHE . 4.1 t -138.49 152.77 48.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 112.044 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.45 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -68.54 121.1 15.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.882 178.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.852 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.36 12.27 11.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -178.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.8 t 67.21 -68.81 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER -118.25 -161.62 0.84 Allowed 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 121.064 0.459 . . . . 0.0 111.685 -178.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.15 -71.3 0.53 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.711 -179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.445 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.72 -22.14 33.12 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.192 0.52 . . . . 0.0 110.759 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.677 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.1 m -73.04 -37.67 66.79 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 177.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.852 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.68 -21.82 47.68 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.454 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.1 tpt180 -76.4 -43.33 40.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.782 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.49 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.3 m120 -92.65 -49.08 6.27 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.485 0.491 . . . . 0.0 112.181 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.06 -50.14 62.77 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.831 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.96 -49.79 64.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.818 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -47.76 -33.38 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.5 OUTLIER -72.37 -41.44 66.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.878 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.3 t -77.22 -42.88 35.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.841 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.079 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.32 -36.06 82.43 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.888 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -77.92 -29.64 50.18 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -50.2 -28.0 6.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.476 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.71 -49.41 5.87 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.601 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.52 53.73 0.79 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.033 -0.604 . . . . 0.0 112.545 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.67 -41.91 21.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -31.74 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.879 -0.601 . . . . 0.0 112.602 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.55 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -110.13 161.97 12.78 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.689 -0.767 . . . . 0.0 113.412 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.2 p -116.84 135.48 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.885 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -94.26 159.51 15.1 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 -177.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.91 98.34 4.58 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.064 -1.88 . . . . 0.0 107.558 177.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.643 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.97 142.03 27.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.469 0.652 . . . . 0.0 112.366 -177.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.74 161.59 14.02 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.821 -1.081 . . . . 0.0 110.224 179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.01 -34.68 12.94 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.194 0.997 . . . . 0.0 108.929 178.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.77 -37.42 76.25 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.976 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 p -103.08 -39.74 6.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.436 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 7.1 mttp 78.09 37.74 0.2 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.585 0.707 . . . . 0.0 109.84 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.814 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -137.76 139.65 40.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.922 -1.036 . . . . 0.0 111.464 -178.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -107.56 151.84 25.07 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.236 178.392 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.1 m -126.25 101.17 6.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.044 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.079 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.11 93.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 121.695 0.759 . . . . 0.0 110.545 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.6 tt0 -105.54 133.24 50.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.389 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.975 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.413 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.782 0.325 . . . . 0.0 110.947 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.622 ' CG ' HD21 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -83.25 88.75 6.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.126 0.489 . . . . 0.0 110.588 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.507 ' CD2' ' CE2' ' A' ' 45' ' ' TYR . 13.5 m-30 -110.38 149.41 30.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.887 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.757 ' O ' HG22 ' A' ' 51' ' ' THR . 2.2 tm? -109.22 135.98 49.43 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.755 HG21 ' CE3' ' A' ' 43' ' ' TRP . 2.3 p -116.62 147.67 19.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.649 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 4.0 m -137.27 113.58 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-O 121.609 0.718 . . . . 0.0 110.357 178.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.585 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -88.58 128.46 35.57 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.475 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.547 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -137.9 115.03 10.91 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.249 179.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.9 -120.65 2.37 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.422 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.78 -30.11 4.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.657 0.265 . . . . 0.0 111.667 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -145.93 43.46 1.24 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.031 0.443 . . . . 0.0 111.183 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -177.61 123.58 0.12 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.886 0.374 . . . . 0.0 111.51 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -136.79 115.31 11.92 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.19 0.519 . . . . 0.0 110.702 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.5 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -138.43 135.84 35.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.359 -179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.835 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.22 125.07 21.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 111.694 -179.728 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.466 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 p -139.97 151.38 45.47 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.508 0.67 . . . . 0.0 112.115 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.949 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -118.65 125.08 48.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.691 -1.14 . . . . 0.0 109.41 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.741 ' N ' HD22 ' A' ' 17' ' ' LEU . 0.7 OUTLIER -138.46 152.57 48.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.924 0.392 . . . . 0.0 111.831 -179.331 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HA ' ' HD1' ' A' ' 2' ' ' TYR . 0.9 OUTLIER -73.32 120.6 19.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.13 179.011 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.853 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.4 14.83 12.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.3 t 68.24 -69.79 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.413 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -117.27 -161.89 0.84 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.244 0.545 . . . . 0.0 111.718 -178.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.4 -71.93 0.51 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.758 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.441 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 41.3 mt-10 -57.42 -21.74 38.6 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.073 0.463 . . . . 0.0 110.455 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.663 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.7 m -73.02 -37.19 67.01 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.853 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.24 -21.76 45.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.446 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.3 OUTLIER -76.72 -42.4 41.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.654 178.636 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.472 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.7 t30 -92.18 -47.27 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.2 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -70.27 -50.02 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.629 ' HB3' ' O ' ' A' ' 26' ' ' ALA . 0.7 OUTLIER -65.29 -49.19 70.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.375 -179.154 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.839 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.93 -34.56 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.6 mt-30 -65.15 -49.99 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.958 0.408 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.2 t -72.7 -41.39 65.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.319 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.072 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.97 -38.54 88.93 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.784 ' N ' HD13 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -77.65 -28.88 51.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.71 -26.91 25.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.14 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -93.41 -49.46 5.91 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.704 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.76 54.03 0.77 Allowed Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.357 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.56 -43.33 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.62 -30.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.614 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.09 162.36 13.48 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.298 -179.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.6 p -116.49 136.48 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.839 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -97.03 157.73 15.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -177.584 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 98.06 4.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.817 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.638 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.53 143.84 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.494 0.664 . . . . 0.0 112.38 -177.546 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.91 161.04 14.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.051 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.69 -35.17 12.28 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.866 0.841 . . . . 0.0 108.809 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.71 -37.14 78.05 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.703 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.402 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.94 -40.1 7.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.818 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 78.85 37.93 0.15 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.55 0.69 . . . . 0.0 109.779 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.757 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.5 OUTLIER -137.66 139.03 40.01 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.459 -178.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.638 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -106.79 152.44 23.85 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.5 m -128.67 102.1 6.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.843 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.072 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.74 95.2 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-O 121.589 0.709 . . . . 0.0 110.462 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.567 ' HG3' HG22 ' A' ' 53' ' ' THR . 2.6 mt-30 -107.24 119.79 40.36 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.345 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.074 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.661 0.267 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.49 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -80.27 82.27 6.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.365 0.602 . . . . 0.0 110.559 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 50' ' ' LYS . 15.0 m-30 -110.62 151.73 27.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.728 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.88 ' HG ' HG22 ' A' ' 51' ' ' THR . 2.2 pp -111.71 140.36 46.4 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.039 -179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.19 145.74 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 120.242 -0.583 . . . . 0.0 111.55 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.781 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.9 m -134.81 114.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 121.439 0.638 . . . . 0.0 110.621 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.688 ' OD1' HG12 ' A' ' 54' ' ' VAL . 0.5 OUTLIER -86.77 128.89 35.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.354 -179.515 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 10.1 mmtt -136.6 114.82 11.62 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.121 178.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.98 -118.3 2.36 Favored Glycine 0 CA--C 1.508 -0.361 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.52 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -119.84 -30.35 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.714 0.292 . . . . 0.0 111.353 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -148.4 44.38 1.04 Allowed 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 120.889 0.376 . . . . 0.0 111.793 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.92 121.17 0.3 Allowed 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.803 0.335 . . . . 0.0 111.733 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -126.92 115.04 18.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.5 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.525 ' HH ' ' HG1' ' A' ' 16' ' ' THR . 0.7 OUTLIER -138.27 133.71 33.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.222 -179.761 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.93 132.21 32.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.18 0.514 . . . . 0.0 111.348 179.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.525 ' HG1' ' HH ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -139.51 149.24 43.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.624 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -125.28 121.22 33.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.073 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.732 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.3 t -138.57 152.74 48.44 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 2.7 tttp -73.36 123.85 24.61 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.996 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.884 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.53 11.97 11.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.7 t 69.54 -64.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.08 -162.29 0.92 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-O 121.093 0.473 . . . . 0.0 111.345 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.38 -71.15 0.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.594 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 3.2 mt-10 -57.02 -21.92 34.61 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.157 0.503 . . . . 0.0 110.59 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.646 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 2.4 m -72.82 -37.55 67.45 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.884 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -79.02 -21.79 46.41 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 176.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.449 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -77.52 -41.75 38.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.886 178.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.475 ' O ' HG22 ' A' ' 31' ' ' ILE . 1.6 t-20 -91.89 -48.0 7.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.164 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.44 -49.94 50.37 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.732 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -65.58 -49.22 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.598 -179.161 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.781 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -48.84 -34.18 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -69.25 -49.3 57.48 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.779 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.9 t -71.79 -42.67 66.82 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.552 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.69 -38.24 87.12 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.838 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -76.71 -29.68 56.35 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -51.5 -27.23 10.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.149 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 1.2 m-20 -93.31 -49.3 6.02 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.735 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 54.12 0.77 Allowed Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.415 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -50.66 -42.94 23.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.582 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -32.43 -30.19 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.617 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.576 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.59 161.96 13.11 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.657 -0.783 . . . . 0.0 113.405 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.72 136.1 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.894 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.81 159.68 14.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -177.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.79 97.65 4.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 112.988 -1.915 . . . . 0.0 107.526 177.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.68 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.16 144.63 25.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.575 0.702 . . . . 0.0 112.759 -177.377 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.76 161.72 13.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.03 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.07 -34.71 11.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 0.0 108.917 179.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.2 -37.08 76.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.35 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.425 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 10.6 p -101.49 -42.7 6.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.996 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.7 OUTLIER 82.23 40.37 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.98 0.895 . . . . 0.0 109.228 -178.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.88 HG22 ' HG ' ' A' ' 4' ' ' LEU . 56.5 p -137.43 140.8 41.51 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.361 -1.29 . . . . 0.0 111.855 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -113.23 148.55 35.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.827 178.228 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.789 HG22 ' HG3' ' A' ' 55' ' ' GLN . 18.2 m -125.49 101.68 7.04 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.84 94.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.675 0.75 . . . . 0.0 110.759 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.789 ' HG3' HG22 ' A' ' 53' ' ' THR . 25.6 mt-30 -105.87 130.67 53.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.353 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.958 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 19' ' ' LYS . 2.6 mtt . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.725 0.298 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.418 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -65.83 69.0 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.655 -179.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.404 ' N ' ' O ' ' A' ' 1' ' ' MET . 6.0 m-85 -130.36 149.77 51.89 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.675 0.274 . . . . 0.0 110.569 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.857 ' O ' HG22 ' A' ' 51' ' ' THR . 0.2 OUTLIER -139.44 155.85 47.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.261 179.354 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.754 HG21 ' HE3' ' A' ' 43' ' ' TRP . 4.0 p -126.7 150.75 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.648 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.774 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 12.3 m -136.57 114.3 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-O 121.375 0.607 . . . . 0.0 110.24 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 6.8 t-20 -85.71 129.83 34.72 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.357 -179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 11.9 mmtt -135.51 114.64 12.28 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.126 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.86 -121.44 2.56 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.972 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -115.15 -30.42 6.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 122.442 -0.446 . . . . 0.0 110.853 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.85 38.38 0.52 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.054 0.454 . . . . 0.0 111.339 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.07 119.91 3.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.555 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -124.53 116.01 21.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.481 ' CZ ' ' CB ' ' A' ' 37' ' ' ASP . 6.9 t80 -137.88 127.47 25.08 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.703 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.774 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -135.57 136.47 41.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.111 0.481 . . . . 0.0 110.515 179.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.658 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -138.9 140.48 38.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.593 0.711 . . . . 0.0 112.111 -179.746 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.801 HD12 ' CB ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -111.16 118.22 35.36 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.723 178.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.35 153.12 48.97 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.07 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 1' ' ' MET . 20.0 mmtp -74.84 99.02 3.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.706 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 26' ' ' ALA . . . -91.34 13.06 18.44 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.457 ' HA ' ' CG ' ' A' ' 1' ' ' MET . 21.6 t 60.54 -72.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.9 OUTLIER -115.24 -160.95 0.76 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.036 0.446 . . . . 0.0 111.738 -179.134 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -87.5 -73.51 0.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.686 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.82 -21.46 42.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.199 0.523 . . . . 0.0 110.163 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.638 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 1.6 m -72.05 -37.92 69.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 177.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.661 ' HA ' ' HB1' ' A' ' 20' ' ' ALA . . . -72.07 -22.09 61.42 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.445 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.0 OUTLIER -80.17 -43.74 21.05 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.164 178.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.437 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 1.1 m-20 -91.37 -48.24 7.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.83 -49.91 59.62 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.635 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.24 -50.0 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.699 -178.722 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.745 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -49.26 -34.55 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.2 mm-40 -65.73 -49.89 66.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 m -72.38 -42.6 65.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.302 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.09 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.16 -38.41 86.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.728 ' N ' HD13 ' A' ' 34' ' ' LEU . 16.0 mttp -76.65 -30.0 56.65 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 177.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.67 -28.2 54.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.327 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.481 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -93.6 -49.54 5.83 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.087 179.504 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.43 53.39 0.77 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.684 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -50.43 -42.23 20.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -31.78 -30.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -108.49 162.18 13.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.605 -0.807 . . . . 0.0 113.19 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.4 p -116.27 135.71 55.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.818 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -97.54 158.91 15.23 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -177.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.47 96.91 4.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 113.115 -1.857 . . . . 0.0 107.425 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.67 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.51 149.02 21.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.4 OUTLIER -104.99 161.68 14.0 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.625 -1.17 . . . . 0.0 109.79 178.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.26 -34.84 11.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.851 0.834 . . . . 0.0 108.862 178.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.18 -36.04 78.77 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.208 -1.36 . . . . 0.0 110.772 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 13.5 p -99.4 -37.34 9.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.578 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 5.8 mmtm 78.55 37.42 0.18 Allowed 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.749 0.785 . . . . 0.0 109.801 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.857 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.6 155.5 49.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.491 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -125.31 150.77 46.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.925 179.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.8 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.94 100.99 7.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.649 -0.251 . . . . 0.0 110.347 -179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.09 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -75.29 95.66 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.151 0 CA-C-O 121.585 0.707 . . . . 0.0 110.327 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 4.6 tt0 -104.88 129.23 53.27 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.192 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.117 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HA ' ' H ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.914 0.387 . . . . 0.0 111.055 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.512 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -161.7 80.17 0.57 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.598 -179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.837 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.9 m-85 -116.47 150.92 37.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.25 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.871 ' O ' HG22 ' A' ' 51' ' ' THR . 0.0 OUTLIER -118.16 140.0 50.43 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.753 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -128.57 144.47 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 119.897 -0.721 . . . . 0.0 112.664 -179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.733 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.34 114.93 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.05 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.544 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 5.5 t-20 -83.94 129.3 34.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 4.3 mmtt -135.46 114.62 12.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.989 178.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.13 -125.73 2.89 Favored Glycine 0 CA--C 1.507 -0.468 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.544 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -116.85 -30.19 5.81 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.621 -0.341 . . . . 0.0 111.334 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -146.52 42.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.425 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -173.71 127.5 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.076 0.465 . . . . 0.0 111.562 -179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -133.96 115.6 14.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.682 179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.536 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.3 OUTLIER -138.11 129.77 28.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.339 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.733 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.39 126.0 23.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.0 0.429 . . . . 0.0 111.176 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 69.2 p -138.41 145.34 40.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.559 0.695 . . . . 0.0 111.533 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.856 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -119.25 120.0 35.72 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.137 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.652 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.5 OUTLIER -138.63 152.72 48.34 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tptt -57.36 130.48 46.42 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.704 ' CB ' ' HB2' ' A' ' 26' ' ' ALA . . . -120.46 10.97 11.29 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.412 ' H ' ' HA ' ' A' ' 1' ' ' MET . 21.3 t 63.8 -65.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.8 OUTLIER -125.49 -160.04 0.94 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 120.97 0.414 . . . . 0.0 111.091 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.39 -72.14 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.585 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.0 -20.55 39.31 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.275 0.56 . . . . 0.0 110.103 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 4.9 m -71.95 -37.4 69.97 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 177.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.62 -23.15 61.65 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.45 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.8 OUTLIER -79.22 -43.17 24.33 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.528 179.198 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 31' ' ' ILE . 11.1 t-20 -92.7 -47.43 7.09 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.75 -50.18 58.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.652 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -68.23 -48.5 64.97 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.84 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.07 -34.44 4.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.421 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.6 mm-40 -70.32 -44.68 67.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.968 0.413 . . . . 0.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.1 t -75.43 -42.96 52.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.703 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.086 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.37 -36.69 83.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 179.237 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.872 ' N ' HD13 ' A' ' 34' ' ' LEU . 7.5 mttm -78.28 -29.68 48.04 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -51.3 -28.1 11.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.475 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -93.58 -49.39 5.91 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.771 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.63 53.36 0.8 Allowed Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.92 -41.83 22.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -31.8 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.594 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 39' ' ' VAL . . . -109.61 162.1 12.82 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.575 -0.822 . . . . 0.0 113.13 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.9 p -116.71 135.74 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.84 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -94.46 158.95 15.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -177.548 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.55 97.01 4.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 113.117 -1.856 . . . . 0.0 107.41 177.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.684 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.37 147.41 23.25 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.87 161.75 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.953 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.98 -34.64 11.71 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.84 0.828 . . . . 0.0 108.874 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.2 -36.98 78.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.414 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 11.1 p -100.44 -38.48 8.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.971 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 79.54 37.23 0.13 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.565 0.697 . . . . 0.0 109.979 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.871 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -137.56 150.45 47.49 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.706 -178.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.684 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -119.74 152.18 37.6 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.121 178.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.793 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 1.9 m -125.67 101.98 7.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.086 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.0 94.91 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-O 121.71 0.767 . . . . 0.0 110.358 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.7 tt0 -106.71 132.24 52.92 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.414 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.986 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.447 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.69 0.281 . . . . 0.0 111.126 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.447 ' CD1' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -110.76 115.99 30.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.974 0.416 . . . . 0.0 110.654 -179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.447 ' CE1' ' HB3' ' A' ' 1' ' ' MET . 43.9 m-85 -131.51 151.87 51.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.448 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.944 ' HG ' HG22 ' A' ' 51' ' ' THR . 4.3 pp -120.19 143.1 48.42 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.251 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.742 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.2 p -118.49 149.63 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.19 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.838 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m -137.61 114.23 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 121.54 0.686 . . . . 0.0 110.462 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.622 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -88.01 126.82 35.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.412 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.562 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -132.72 114.93 14.74 Favored 'General case' 0 CA--C 1.527 0.076 0 CA-C-O 121.234 0.54 . . . . 0.0 111.044 178.885 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.51 -125.62 3.03 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.252 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -112.79 -30.27 7.12 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.858 0.361 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -150.56 43.52 0.84 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.943 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.69 125.25 1.19 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.068 0.461 . . . . 0.0 111.678 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -129.21 115.87 18.3 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.533 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.561 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -137.8 125.98 23.02 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.455 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.838 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -137.97 125.97 22.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.227 0.537 . . . . 0.0 111.562 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.579 ' C ' HD13 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -139.78 151.92 46.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.514 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.909 HD12 ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.32 126.1 47.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.829 178.667 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.799 HG22 ' CE1' ' A' ' 30' ' ' PHE . 3.8 t -138.28 153.54 49.05 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' HD2' ' CD1' ' A' ' 2' ' ' TYR . 12.4 tptt -61.72 121.3 12.5 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.445 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' O ' ' N ' ' A' ' 22' ' ' ASP . . . -120.45 28.87 7.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.641 ' CG2' HG21 ' A' ' 25' ' ' THR . 34.5 m 38.81 -60.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.785 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.3 OUTLIER -118.95 -163.16 0.95 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.113 0.483 . . . . 0.0 111.426 -179.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.8 -71.73 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.299 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -57.51 -20.75 33.4 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.154 0.502 . . . . 0.0 110.195 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.657 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 3.1 m -71.96 -38.22 69.8 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.625 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . . . -71.11 -22.89 62.03 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 176.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.438 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -80.24 -44.07 20.33 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.537 179.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.447 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 12.4 m-20 -92.36 -46.47 7.67 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.657 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -67.54 -49.97 60.82 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.799 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.5 OUTLIER -66.91 -50.14 63.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.78 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.74 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.49 -34.45 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -64.91 -50.09 67.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.529 179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 t -72.6 -41.4 65.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.037 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.085 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.31 -38.01 87.77 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.677 ' N ' HD13 ' A' ' 34' ' ' LEU . 31.6 mttt -77.59 -29.23 51.89 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -57.8 -27.64 63.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.307 178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.37 -49.61 5.85 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.934 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.64 53.54 0.76 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.484 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.2 -43.06 27.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -32.6 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.623 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.89 162.25 13.25 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.623 -0.799 . . . . 0.0 113.256 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.23 136.59 52.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.85 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -98.79 158.84 15.36 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.431 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.74 96.52 4.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 112.98 -1.918 . . . . 0.0 107.73 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.631 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.13 144.69 25.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.438 0.637 . . . . 0.0 112.406 -177.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.13 161.68 14.04 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.88 178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.62 -35.15 12.33 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.31 77.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.553 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.422 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 9.6 p -100.81 -41.33 6.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.233 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 80.33 38.95 0.09 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 122.047 0.927 . . . . 0.0 109.073 -178.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.944 HG22 ' HG ' ' A' ' 4' ' ' LEU . 50.0 p -138.19 141.25 40.03 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.428 -1.26 . . . . 0.0 111.98 -178.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.631 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -111.9 148.12 34.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.759 178.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.757 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 7.3 m -124.62 100.75 6.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.599 -179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.085 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.52 95.82 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.182 0 CA-C-O 121.582 0.706 . . . . 0.0 110.54 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.562 ' HG2' ' HB2' ' A' ' 8' ' ' LYS . 11.6 mt-30 -104.37 123.43 47.4 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.13 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.623 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.524 ' HA ' ' N ' ' A' ' 20' ' ' ALA . 7.7 ttm . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.592 0.234 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.479 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 0.0 OUTLIER -67.29 71.27 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 179.433 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -121.9 148.69 44.43 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.043 0.449 . . . . 0.0 111.067 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.835 HD21 ' HG3' ' A' ' 15' ' ' GLU . 1.2 tm? -131.05 140.71 50.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.75 ' H ' HD22 ' A' ' 4' ' ' LEU . 3.5 p -121.65 148.36 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.533 179.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.848 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 6.0 m -136.63 114.45 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 121.505 0.669 . . . . 0.0 110.703 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 4.5 t-20 -87.89 128.79 35.36 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.229 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 31.8 tptt -137.7 115.07 11.07 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.223 0.535 . . . . 0.0 111.272 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.65 -121.49 2.57 Favored Glycine 0 CA--C 1.508 -0.4 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.459 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -116.89 -30.22 5.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 O-C-N 122.458 -0.436 . . . . 0.0 110.999 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -148.77 43.33 0.99 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.069 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.52 125.96 0.74 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.04 0.448 . . . . 0.0 111.572 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.431 ' CE1' ' HD2' ' A' ' 8' ' ' LYS . 7.2 m-85 -133.0 115.63 15.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.803 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.563 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -137.83 128.55 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.517 -179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -138.03 127.53 24.89 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 121.098 0.475 . . . . 0.0 111.641 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.439 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.6 OUTLIER -139.59 149.19 43.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 111.602 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.839 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -121.59 126.99 50.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.901 178.316 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.653 HG22 ' CE1' ' A' ' 30' ' ' PHE . 1.0 OUTLIER -138.43 152.9 48.77 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 112.03 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 1' ' ' MET . 10.4 mptt -69.22 93.67 0.63 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.865 178.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -87.19 15.62 6.04 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 64.55 -68.07 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 20' ' ' ALA . 7.8 m-20 -122.45 -160.17 0.87 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.006 0.431 . . . . 0.0 111.098 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.63 -71.52 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.661 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -57.58 -21.76 40.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.186 0.517 . . . . 0.0 110.395 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.626 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 9.6 m -72.2 -37.43 69.25 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 177.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.747 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -73.7 -21.84 60.11 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 176.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 0.4 OUTLIER -80.23 -42.37 23.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.12 178.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' ILE . 29.7 m-80 -91.41 -48.11 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -69.28 -50.2 49.08 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.653 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.2 OUTLIER -65.1 -50.01 67.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.432 -179.063 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.817 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.85 -34.36 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.435 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -64.23 -49.85 70.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.464 179.806 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.2 m -74.82 -39.0 61.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.099 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -63.36 -38.41 91.06 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.645 ' N ' HD13 ' A' ' 34' ' ' LEU . 6.4 mtmt -79.84 -28.12 40.13 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.85 -27.26 64.96 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.45 -49.53 5.87 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.816 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.67 53.63 0.76 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.487 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.5 OUTLIER -51.41 -42.8 28.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -179.774 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -31.94 -30.44 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.507 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -107.69 162.19 13.33 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.303 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.3 p -116.3 136.02 54.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.828 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.86 158.93 15.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 115.351 1.612 . . . . 0.0 115.351 -177.462 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.62 97.41 4.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 113.106 -1.861 . . . . 0.0 107.571 177.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.669 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.48 147.9 22.79 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -176.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.96 161.84 13.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.746 -1.115 . . . . 0.0 110.032 179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.74 -34.71 11.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.843 0.83 . . . . 0.0 108.913 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.08 -37.09 78.9 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.454 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.428 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 12.9 p -99.53 -41.46 7.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.132 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.553 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.01 38.09 0.06 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.773 0.796 . . . . 0.0 109.552 -179.317 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.585 ' O ' ' HA ' ' A' ' 45' ' ' TYR . 4.5 p -137.71 151.95 48.75 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.49 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.669 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -120.58 150.74 40.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.078 179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.781 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 8.4 m -124.71 101.19 6.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.038 HG21 HD11 ' A' ' 34' ' ' LEU . 1.4 t -75.5 96.42 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.222 0 CA-C-O 121.607 0.718 . . . . 0.0 110.587 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.657 ' HG3' HG22 ' A' ' 53' ' ' THR . 5.4 mt-30 -106.64 127.75 53.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.155 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.4 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.071 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.443 ' H2 ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.821 0.343 . . . . 0.0 110.982 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 1.1 p90 -158.8 83.94 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.588 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 52' ' ' PHE . 2.7 m-85 -119.19 151.07 39.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.742 0.306 . . . . 0.0 110.663 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.908 HD21 ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -125.66 135.09 51.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.904 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.6 p -118.72 147.16 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 C-N-CA 120.327 -0.549 . . . . 0.0 111.754 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.832 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 8.5 m -134.53 114.34 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-O 121.511 0.672 . . . . 0.0 110.713 179.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 14.7 t-20 -85.63 125.6 33.27 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.247 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 7.8 mmtp -132.3 114.35 14.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.982 0.42 . . . . 0.0 111.068 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.22 -121.65 2.68 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.336 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -115.36 -30.36 6.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.75 0.31 . . . . 0.0 110.995 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.11 39.11 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.728 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.53 121.68 3.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.803 0.335 . . . . 0.0 111.55 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -126.18 115.56 19.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.79 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.518 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -137.77 126.41 23.71 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.159 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.908 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 128.34 26.92 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.062 0.458 . . . . 0.0 111.543 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.493 ' OG1' ' CZ ' ' A' ' 14' ' ' TYR . 0.3 OUTLIER -139.57 149.96 44.47 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.459 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -127.93 123.14 34.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.865 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.719 HG22 ' CE1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -138.6 152.76 48.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 111.8 -178.722 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -48.24 128.51 14.32 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.31 10.04 11.17 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 -177.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.6 t 56.46 -70.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.619 0.247 . . . . 0.0 111.522 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ALA . 1.2 t70 -124.36 -159.69 0.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.889 0.376 . . . . 0.0 110.625 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -85.44 -70.05 0.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.75 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.23 -20.26 26.31 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.171 0.51 . . . . 0.0 110.646 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.659 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 59.6 m -72.93 -37.3 67.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.863 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.33 -23.62 60.27 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.469 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 18.6 tpt180 -77.86 -43.97 28.66 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.262 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.443 ' O ' ' CG ' ' A' ' 32' ' ' GLN . 22.5 t-20 -92.62 -48.19 6.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.63 -50.15 63.92 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.719 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -68.32 -49.26 61.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.849 0.315 . . . . 0.0 111.849 -178.766 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.8 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.5 tt -48.42 -34.88 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.443 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mm-40 -64.76 -50.05 68.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.419 . . . . 0.0 110.551 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 m -73.24 -42.43 62.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.191 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -60.2 -38.84 84.54 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.688 ' N ' HD13 ' A' ' 34' ' ' LEU . 8.8 mttt -78.17 -28.75 48.31 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -57.71 -27.76 63.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.214 178.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -93.48 -49.53 5.87 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.872 179.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.06 53.42 0.78 Allowed Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.452 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.494 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -51.54 -42.8 30.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -32.75 -30.2 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.62 -178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.593 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -107.58 162.08 13.41 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.53 -0.843 . . . . 0.0 113.173 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.54 136.24 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.888 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -97.72 158.77 15.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -177.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.62 96.47 4.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 112.989 -1.914 . . . . 0.0 107.468 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.01 147.49 22.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -176.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.88 161.9 13.79 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.923 178.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.96 -35.43 11.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.89 0.852 . . . . 0.0 108.845 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.06 -36.61 77.73 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.178 -1.373 . . . . 0.0 110.291 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -100.18 -39.97 7.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.184 -179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.0 OUTLIER 80.06 37.77 0.11 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.737 0.78 . . . . 0.0 109.729 -179.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.755 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -137.67 152.85 49.73 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.311 -179.02 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -121.56 151.23 40.57 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.136 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.765 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.0 m -123.38 99.82 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.301 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.025 HG21 HD11 ' A' ' 34' ' ' LEU . 1.2 t -75.35 94.54 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.063 0 CA-C-O 121.589 0.709 . . . . 0.0 110.397 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.1 tt0 -104.08 128.29 51.7 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.307 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.012 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.411 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.571 0.224 . . . . 0.0 110.876 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.464 ' CZ ' ' CG ' ' A' ' 19' ' ' LYS . 1.8 m-85 -85.74 99.05 11.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.213 0.53 . . . . 0.0 110.378 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.754 ' C ' HD13 ' A' ' 4' ' ' LEU . 54.3 m-85 -115.9 151.94 34.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.126 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.81 HD12 ' CB ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -110.6 139.02 46.25 Favored 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.487 -178.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.793 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.1 p -126.38 144.07 37.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.11 -0.636 . . . . 0.0 112.388 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.741 HG12 ' HB3' ' A' ' 15' ' ' GLU . 6.9 m -134.82 114.61 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.658 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.552 ' HB3' ' O ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -87.12 130.65 34.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.379 -179.489 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.53 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 28.0 mmtt -137.91 114.94 10.83 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.075 0.464 . . . . 0.0 111.229 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.97 -121.12 2.52 Favored Glycine 0 CA--C 1.509 -0.321 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.441 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.79 -30.18 4.82 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.509 -0.406 . . . . 0.0 111.251 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -146.2 43.28 1.22 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.93 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -175.55 123.35 0.21 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.862 0.363 . . . . 0.0 111.614 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -130.72 115.22 16.36 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.615 179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.552 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 0.1 OUTLIER -138.31 132.39 31.54 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 123.362 0.414 . . . . 0.0 109.968 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.1 mt-10 -137.91 125.26 21.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.168 0.508 . . . . 0.0 111.043 -179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.746 ' O ' HG12 ' A' ' 5' ' ' VAL . 70.7 p -138.18 149.08 45.5 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.706 0.765 . . . . 0.0 111.601 -179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.81 ' CB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -122.43 120.24 33.35 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.268 179.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.715 HG22 ' CD1' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.29 152.54 48.63 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.063 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.464 ' CG ' ' CZ ' ' A' ' 2' ' ' TYR . 1.4 tmtt? -68.38 123.61 21.26 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.079 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.875 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.49 16.28 12.09 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.4 t 68.36 -66.79 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER -123.94 -162.6 1.07 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.142 0.496 . . . . 0.0 111.557 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.54 -71.96 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.708 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HA ' ' CB ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -57.2 -21.62 34.81 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.18 0.515 . . . . 0.0 110.409 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.653 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 6.7 m -72.66 -37.19 68.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 177.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.875 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -78.59 -21.95 47.82 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.455 ' O ' ' HB ' ' A' ' 31' ' ' ILE . 1.6 tpt85 -76.88 -42.11 41.17 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.665 178.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.517 ' O ' HG22 ' A' ' 31' ' ' ILE . 8.0 t-20 -92.56 -49.16 6.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.59 -50.15 53.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.715 ' CD1' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -66.59 -47.43 72.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.617 -178.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.912 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.7 tt -49.57 -33.68 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.438 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 2.3 mm-40 -73.05 -39.34 65.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.001 0.429 . . . . 0.0 110.727 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 m -78.2 -42.91 29.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.863 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.109 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -64.91 -34.62 78.83 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.26 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.921 ' N ' HD13 ' A' ' 34' ' ' LEU . 13.8 mtmm -77.96 -29.87 50.03 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -49.84 -28.0 5.85 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.276 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.474 ' CB ' ' CE2' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.44 -49.37 5.95 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.665 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.22 53.79 0.79 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.35 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.583 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -51.39 -42.05 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -31.52 -30.46 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.167 0.587 . . . . 0.0 112.527 -178.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.587 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -110.2 162.43 12.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.78 -0.724 . . . . 0.0 113.061 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.62 136.09 54.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.912 ' CE2' HD12 ' A' ' 31' ' ' ILE . 0.1 OUTLIER -92.44 157.62 16.48 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -177.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 m -130.54 96.78 4.2 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.22 -1.809 . . . . 0.0 106.83 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.656 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.27 145.35 24.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.522 0.677 . . . . 0.0 112.573 -177.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.07 159.8 15.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.832 178.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.77 -35.81 12.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.879 0.847 . . . . 0.0 108.762 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.04 76.92 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.112 -1.404 . . . . 0.0 110.405 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 6.8 p -100.41 -39.23 8.07 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.994 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.5 OUTLIER 79.21 36.58 0.15 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.502 0.668 . . . . 0.0 109.987 -179.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.807 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -138.02 140.46 40.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.669 -178.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.97 153.21 23.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.051 178.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.804 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.2 m -128.73 102.55 6.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.426 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.109 HG21 HD11 ' A' ' 34' ' ' LEU . 2.1 t -75.02 94.34 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.637 0.732 . . . . 0.0 110.649 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.53 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 1.1 tt0 -107.21 130.89 54.67 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.266 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.574 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.268 -0.873 . . . . 0.0 110.97 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.422 ' O ' ' HD3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.754 0.311 . . . . 0.0 111.127 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -139.11 92.96 2.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.253 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.803 ' C ' HD13 ' A' ' 4' ' ' LEU . 1.6 m-85 -113.9 151.42 32.24 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.647 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.952 HD12 ' HB2' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -123.78 154.94 38.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.773 HG21 ' HE3' ' A' ' 43' ' ' TRP . 3.3 p -133.37 146.35 32.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 120.014 -0.674 . . . . 0.0 112.702 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.799 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 10.8 m -135.53 114.61 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.811 178.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 10.1 t-20 -83.04 130.16 35.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.082 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 1.7 tttt -136.17 114.66 11.8 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.97 0.414 . . . . 0.0 110.932 179.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.84 -126.76 3.06 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.16 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -30.32 7.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.817 0.341 . . . . 0.0 110.967 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -149.57 43.67 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.884 0.373 . . . . 0.0 111.301 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.66 126.31 0.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.881 0.372 . . . . 0.0 111.712 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.434 ' CE1' ' HG3' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -127.79 115.68 19.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.504 ' O ' ' HB3' ' A' ' 7' ' ' ASN . 3.2 t80 -137.9 123.6 19.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.272 -179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.799 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -131.28 135.47 47.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.031 0.443 . . . . 0.0 109.964 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.502 ' O ' ' HZ ' ' A' ' 30' ' ' PHE . 0.6 OUTLIER -138.21 114.03 9.87 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.959 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.952 ' HB2' HD12 ' A' ' 4' ' ' LEU . 0.7 OUTLIER -87.3 113.79 23.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.094 178.585 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.476 ' HB ' ' CE1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -138.29 152.5 48.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.087 -179.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 19.5 mmtm -48.7 150.36 1.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.157 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 1.006 ' HB1' ' HB2' ' A' ' 26' ' ' ALA . . . -120.28 -10.17 9.39 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.8 t 58.69 -69.52 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.945 0.402 . . . . 0.0 110.45 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -127.72 -160.76 1.03 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.28 -70.26 0.65 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.725 0.298 . . . . 0.0 111.363 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 5.0 mm-40 -61.88 -19.19 62.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.186 0.517 . . . . 0.0 110.253 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.602 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 16.3 m -71.91 -39.38 69.57 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 177.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 1.006 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . . . -73.0 -22.65 60.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 24' ' ' GLU . 1.7 tpt180 -78.82 -43.14 25.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.115 -0.948 . . . . 0.0 110.266 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 31' ' ' ILE . 4.0 t30 -91.51 -49.16 6.46 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -66.38 -50.28 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.6 ' HB3' ' HH2' ' A' ' 43' ' ' TRP . 0.2 OUTLIER -66.12 -50.42 64.09 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.726 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.88 -33.74 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.444 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 1.3 mt-30 -65.75 -49.92 66.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.009 0.433 . . . . 0.0 110.536 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -73.64 -42.7 61.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.798 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.044 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.59 -37.55 84.28 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.239 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.761 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -79.56 -29.23 41.23 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.05 -28.18 50.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.313 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.483 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 0.4 OUTLIER -93.68 -49.57 5.8 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.963 179.22 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.33 53.0 0.8 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.68 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -50.85 -42.18 22.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -31.66 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.611 ' CA ' ' HB2' ' A' ' 56' ' ' ALA . . . -108.79 161.98 13.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.576 -0.821 . . . . 0.0 113.139 -179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.7 p -116.45 135.49 56.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.819 ' HA ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -95.14 157.81 15.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 -177.383 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.59 95.83 3.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.342 177.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.681 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.13 147.46 23.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -176.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' O ' ' CZ ' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -105.14 161.82 13.92 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.89 178.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.5 -35.31 11.73 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.858 0.837 . . . . 0.0 108.754 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.9 -37.17 78.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.265 179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.1 p -99.67 -37.15 9.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.189 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.544 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 1.6 mmmm 77.59 36.28 0.28 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.585 0.707 . . . . 0.0 110.087 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -137.64 152.64 49.55 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.301 -179.07 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.681 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -118.55 149.94 40.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.969 179.098 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.819 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 2.4 m -123.21 101.67 7.51 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.044 HG21 HD11 ' A' ' 34' ' ' LEU . 1.3 t -74.82 95.5 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-O 121.694 0.759 . . . . 0.0 110.337 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.517 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 5.5 tt0 -104.07 130.85 51.77 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.269 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' CA ' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.049 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.625 0.25 . . . . 0.0 110.836 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.442 ' CE1' ' HB2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -89.04 106.04 18.18 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.352 0.596 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 50' ' ' LYS . 74.3 m-85 -128.91 152.02 49.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.723 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.95 ' HG ' HG22 ' A' ' 51' ' ' THR . 3.9 pp -115.07 145.09 42.67 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.377 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.789 HG21 ' CE3' ' A' ' 43' ' ' TRP . 3.7 p -124.62 145.66 31.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.839 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.747 HG12 ' HB3' ' A' ' 15' ' ' GLU . 5.3 m -134.3 114.49 18.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' A' ' 54' ' ' VAL . 1.2 t30 -88.21 132.43 34.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.526 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -136.9 114.83 11.39 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 121.082 0.467 . . . . 0.0 111.291 178.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 -120.66 2.95 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.047 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -115.94 -30.1 6.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.717 0.294 . . . . 0.0 111.145 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -151.38 42.19 0.73 Allowed 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.32 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -164.64 124.22 1.91 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.465 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.421 ' CE1' ' HB3' ' A' ' 8' ' ' LYS . 5.8 m-85 -126.87 115.68 19.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.631 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.49 ' CE2' HG23 ' A' ' 16' ' ' THR . 1.7 t80 -137.95 126.33 23.28 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.253 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.747 ' HB3' HG12 ' A' ' 6' ' ' VAL . 1.5 mt-10 -138.08 126.01 22.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.947 0.403 . . . . 0.0 111.529 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.577 ' O ' HG12 ' A' ' 5' ' ' VAL . 61.1 p -138.66 151.71 47.43 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.748 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.808 HD13 ' N ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -124.62 123.48 40.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.518 179.378 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.857 HG22 ' CE1' ' A' ' 30' ' ' PHE . 5.2 t -138.55 152.62 48.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.867 0.365 . . . . 0.0 111.784 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.442 ' HB2' ' CE1' ' A' ' 2' ' ' TYR . 8.3 tttt -71.54 125.12 26.24 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.868 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . . . -120.34 17.61 12.23 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.9 t 67.2 -66.19 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -122.8 -160.17 0.88 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 121.14 0.495 . . . . 0.0 111.333 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.04 -70.69 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.608 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 27' ' ' ARG . 2.2 mt-10 -56.51 -22.22 31.3 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.148 0.499 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.668 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 15.1 m -73.0 -37.24 67.05 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.868 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . . . -77.65 -21.68 51.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 12.4 tpt180 -76.64 -43.68 37.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.775 178.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.467 ' O ' HG22 ' A' ' 31' ' ' ILE . 60.2 t-20 -92.2 -48.36 6.74 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 25' ' ' THR . . . -68.23 -50.01 56.88 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.857 ' CE1' HG22 ' A' ' 18' ' ' THR . 0.6 OUTLIER -65.89 -49.73 67.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.651 -179.062 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.843 HD12 ' CE2' ' A' ' 43' ' ' TRP . 1.6 tt -48.38 -33.8 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.428 ' CG ' ' O ' ' A' ' 28' ' ' ASN . 3.0 mm-40 -72.2 -45.67 59.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.0 0.429 . . . . 0.0 110.629 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.67 -42.84 63.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.38 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.05 HD11 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -62.95 -36.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.849 ' N ' HD13 ' A' ' 34' ' ' LEU . 34.4 mttp -76.71 -29.95 56.45 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -51.22 -27.58 9.34 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.288 178.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 14' ' ' TYR . 0.7 OUTLIER -93.49 -49.4 5.92 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.708 179.18 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.99 53.89 0.78 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.445 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.551 ' N ' ' O ' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -50.4 -42.6 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.565 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -31.84 -30.38 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.612 -178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.569 ' C ' HG13 ' A' ' 54' ' ' VAL . . . -108.15 162.28 13.15 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.703 -0.76 . . . . 0.0 113.401 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.4 p -116.57 135.21 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.845 ' HB3' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -95.47 159.33 15.05 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -177.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.89 97.28 4.28 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 113.149 -1.841 . . . . 0.0 107.716 177.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.655 ' HB2' ' CB ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -93.12 144.17 25.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.381 0.61 . . . . 0.0 112.518 -177.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.04 161.33 14.32 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.818 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -95.19 -35.02 12.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.904 0.859 . . . . 0.0 108.866 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.54 77.03 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.122 -1.399 . . . . 0.0 110.63 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.445 ' O ' ' CB ' ' A' ' 50' ' ' LYS . 8.8 p -100.23 -42.09 6.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.855 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER 82.12 37.93 0.06 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.934 0.873 . . . . 0.0 109.106 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.95 HG22 ' HG ' ' A' ' 4' ' ' LEU . 43.5 p -138.6 139.41 38.57 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.298 -178.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.655 ' CB ' ' HB2' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -108.91 151.09 26.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.787 ' O ' ' HA ' ' A' ' 43' ' ' TRP . 3.3 m -128.22 101.94 6.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.68 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 34' ' ' LEU . 2.0 t -75.76 95.08 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-O 121.401 0.619 . . . . 0.0 110.688 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.5 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 24.7 mt-30 -107.13 123.76 48.71 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.488 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.465 ' HA ' ' HA2' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.054 179.421 . . . . . . . . 1 1 . 1 stop_ save_