data_2lcu_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 2lcu _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 ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.451 0 N-CA-C 109.701 -0.481 . . . . 74.22 109.701 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.34 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.536 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 74.31 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 73.32 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.476 ' HB ' ' CE2' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 72.53 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 72.23 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 73.24 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 74.02 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 75.42 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 75.02 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.416 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 75.32 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 65.54 111.997 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 72.11 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 71.22 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 60.13 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 74.33 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.46 HG22 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 72.11 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.696 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 73.44 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 72.22 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 72.02 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.598 ' O ' HD21 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 73.11 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 65.52 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.652 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 64.23 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.42 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 73.42 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 55.32 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.401 HG13 HG22 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 65.54 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.476 ' CE2' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 71.33 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 74.33 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 74.32 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 75.11 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.421 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.411 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 72.41 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 75.54 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.421 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 73.24 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 73.23 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 61.4 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 71.21 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 72.32 105.956 175.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.416 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 54.41 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.696 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 73.41 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 73.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 73.34 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 74.13 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.415 ' O ' HG22 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 70.33 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 72.22 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 74.03 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.464 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 73.43 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.608 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 75.2 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 70.3 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 73.14 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.507 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 74.42 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.536 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 72.2 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HA ' HG13 ' A' ' 126' ' ' ILE . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 74.21 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 63.5 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.488 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 74.52 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 122' ' ' LEU . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.442 ' N ' HD13 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 74.31 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.465 ' HE1' HG23 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 75.21 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.25 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 74.32 108.814 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 74.3 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 74.51 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 61.13 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.52 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 73.3 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 72.5 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.31 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 75.12 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.578 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.52 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 74.43 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.488 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.417 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 74.45 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 74.4 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 73.24 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 71.45 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 73.43 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.411 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 72.53 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . 0.578 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 71.33 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 72.42 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 74.24 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 64.13 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 74.22 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 71.34 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . 0.45 HG13 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 74.15 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 71.04 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 73.12 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 74.12 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 74.12 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . 0.419 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.401 HG22 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.54 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.608 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 74.14 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 75.31 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 71.11 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . 0.452 ' CG ' ' HZ1' ' A' ' 201' ' ' LYS . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.52 108.795 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 74.42 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 75.23 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . 0.452 ' HZ1' ' CG ' ' A' ' 197' ' ' ASP . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 64.24 110.412 174.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 . . . . . 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.889 0 CA-C-O 121.429 0.633 . . . . 75.14 111.327 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 74.45 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.21 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 75.45 109.33 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 27' ' ' LEU . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.52 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 74.4 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 74.21 110.926 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 73.22 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.533 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 74.41 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 71.35 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 73.33 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 75.1 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 74.31 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.479 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 74.23 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 73.25 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.583 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.411 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 75.43 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.658 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 75.12 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.428 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 63.33 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.3 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 62.32 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 71.45 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 71.33 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 73.53 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 74.22 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 65.2 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 72.02 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 64.32 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.533 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 64.41 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.401 ' O ' HG22 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.15 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 73.13 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 72.31 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 72.31 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 73.23 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 74.42 110.411 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 74.44 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 74.34 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.583 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 75.32 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 62.34 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 71.52 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.508 ' O ' HG22 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 71.45 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 73.44 110.949 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.52 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 74.32 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.463 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 73.4 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 74.25 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 75.53 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 74.42 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.41 HD23 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 65.14 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 75.43 111.193 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 74.42 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.52 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.587 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.518 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 75.32 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.485 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 74.13 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 72.23 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 70.01 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.5 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 73.13 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 74.51 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 75.14 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 75.24 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 75.3 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.535 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 72.02 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 74.4 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.535 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.418 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 73.15 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.474 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.45 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 74.55 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 65.2 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 64.05 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 73.03 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 75.44 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 72.31 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 75.11 110.938 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 73.14 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . 0.448 HD11 HG22 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 75.5 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 75.2 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 75.31 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 72.41 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . 0.41 HG21 HD23 ' A' ' 122' ' ' LEU . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.55 113.144 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 71.45 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.33 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.431 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 53.24 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.431 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 73.14 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 73.02 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 71.45 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . 0.473 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 75.44 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 74.22 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 . . . . . 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.55 111.576 -176.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 121.086 0.469 . . . . 75.3 110.459 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 74.43 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.543 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 75.0 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 71.44 109.374 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 73.41 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 75.41 111.817 -174.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 72.23 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.495 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 70.45 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.501 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.668 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.511 ' O ' HG21 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 63.33 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 74.54 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.41 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 73.11 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 73.2 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 74.44 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.421 ' O ' HG21 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.42 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 64.41 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 74.44 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.41 110.767 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 75.33 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 75.02 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 74.54 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 74.35 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.427 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.531 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 74.44 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 75.32 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 72.23 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 71.41 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 70.33 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 75.22 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.5 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.495 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 64.04 111.376 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.668 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.34 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 73.43 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 43.33 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 71.31 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 72.22 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.521 ' O ' HG22 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.5 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.35 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.521 HG22 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 73.31 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 70.3 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.645 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 73.03 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 74.42 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 71.22 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.645 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.478 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 73.01 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 71.04 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' SER . . . . . 0.478 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 75.41 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 74.24 108.749 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.455 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 75.35 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 124' ' ' ASN . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 73.32 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.455 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.402 ' HA ' ' CG2' ' A' ' 142' ' ' ILE . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 74.31 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 74.31 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 71.34 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 73.13 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 75.35 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 74.41 108.727 172.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.402 ' CG2' ' HA ' ' A' ' 130' ' ' LYS . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . 0.417 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 72.41 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 74.32 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 74.22 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 74.12 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.543 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 62.11 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.435 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 73.14 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 74.02 109.525 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . 0.417 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 74.42 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 73.3 110.814 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.427 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 75.25 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 74.33 109.468 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 74.21 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.52 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 74.21 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.493 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 71.52 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 74.42 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 74.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 74.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 73.04 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . 0.436 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 71.04 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 75.21 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 73.33 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.406 ' HB2' ' OE1' ' A' ' 29' ' ' GLU . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 64.31 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 71.24 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.33 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 74.24 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.455 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 72.43 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 74.33 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 75.42 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 73.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 75.22 111.824 -174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 74.12 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.754 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 75.22 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.484 ' O ' HG21 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 74.22 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.476 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.11 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 73.33 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 72.12 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 74.14 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 75.33 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 64.41 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.461 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.41 HD21 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 65.41 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 73.55 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.432 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 73.13 110.63 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 75.43 111.976 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 73.25 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 64.32 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.404 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 62.54 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.23 111.968 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 73.53 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 74.22 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 75.41 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.32 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 72.14 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.754 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.429 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 72.23 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.41 ' SD ' HD21 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 73.0 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 74.4 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 75.52 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.486 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 75.32 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.502 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 52.7 t-80 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 72.01 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.43 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 71.25 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 71.31 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 71.11 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 74.02 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 73.23 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 72.53 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.619 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.643 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 75.03 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 74.11 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.619 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 75.14 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 74.33 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 71.25 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 60.01 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 54.42 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.454 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 73.14 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 62.5 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.419 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 65.34 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 74.23 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.461 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 74.41 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.525 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 73.24 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.5 ' O ' HG21 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.54 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.33 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.525 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 72.01 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 73.34 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 74.25 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.415 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 74.34 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 75.42 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 72.44 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 73.1 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.404 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 70.15 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.461 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 75.34 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 75.14 111.348 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 71.04 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 75.4 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 75.25 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 74.41 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 75.42 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 72.54 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.541 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 71.32 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.541 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 74.51 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.41 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 75.01 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.498 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 71.44 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 75.24 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 75.44 110.572 -176.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 71.42 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 72.24 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 72.13 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 62.51 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.645 0 N-CA-C 107.737 -1.209 . . . . 71.0 107.737 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.23 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.41 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 65.43 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 71.45 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 75.51 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 72.31 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' HG13 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.51 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 73.22 110.799 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 72.43 111.047 179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 71.1 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.3 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.41 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 74.33 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.515 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 75.15 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.44 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 74.04 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 73.24 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 73.14 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 70.51 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.414 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 74.24 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.43 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 71.31 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.647 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 74.43 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 72.12 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 55.25 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.52 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.43 109.488 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 72.04 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 75.53 111.948 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.455 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 75.32 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 75.11 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 64.21 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 70.33 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 75.43 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 73.12 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 75.23 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 72.02 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 65.22 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 73.3 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 71.55 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.428 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 72.12 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 74.45 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.428 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 74.44 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 74.32 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 107' ' ' SER . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 75.35 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 73.43 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 75.35 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 72.23 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.748 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.4 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 74.24 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 74.45 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 73.42 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.486 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 75.52 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 71.24 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 71.31 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.486 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 72.25 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.473 ' HA ' HG11 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.43 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 74.23 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 63.52 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 72.03 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.44 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 72.54 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.473 HG11 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 74.42 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 74.3 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.523 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 75.05 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . 0.44 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 75.13 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 72.21 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.45 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.748 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.52 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 70.33 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 63.24 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.402 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 73.11 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 74.24 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 75.03 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 75.42 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 73.24 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 74.34 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 74.24 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 61.35 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 75.22 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 74.3 110.742 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 75.23 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 64.14 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.475 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 72.04 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . 0.647 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.553 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 54.25 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.553 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 73.34 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 64.31 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 75.42 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' THR . . . . . 0.463 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 75.3 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 73.13 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 72.12 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 72.32 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 73.52 109.57 178.208 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 72.45 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.414 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 71.12 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 74.12 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 53.43 110.187 177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 74.31 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 62.42 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 73.11 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.486 HH22 HD21 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 74.14 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 61.54 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 70.3 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.486 HD21 HH22 ' A' ' 37' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 70.24 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 74.15 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.484 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 72.35 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 70.15 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.73 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 71.4 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 73.2 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 73.22 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.43 HG22 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 74.34 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 65.14 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 75.12 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 74.44 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 75.14 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 75.32 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.659 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 63.43 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 64.12 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 64.33 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.404 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 71.33 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 74.42 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 74.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 73.23 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 65.23 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 72.33 110.828 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 75.45 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 64.33 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.444 ' CD ' ' HZ1' ' A' ' 80' ' ' LYS . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 75.24 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.25 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 62.05 110.778 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 74.13 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 62.31 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 72.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.73 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 72.33 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 65.14 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.444 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 73.2 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 73.21 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.504 ' O ' HG21 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.467 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 63.31 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 71.45 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 75.23 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 73.41 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 74.21 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 63.32 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.55 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 75.12 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 73.22 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.14 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.35 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 75.41 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 73.35 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 71.11 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 74.04 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 74.35 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 73.51 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 74.53 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.487 ' HA ' HG13 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 73.31 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 73.45 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 73.24 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 73.32 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 74.31 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 71.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 74.33 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . 0.503 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 72.25 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 75.0 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.23 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 73.21 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.516 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 64.02 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 71.31 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 74.31 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 70.4 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . 0.414 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 52.3 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.4 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 72.22 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 75.0 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 75.13 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 74.41 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 72.32 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 74.32 109.299 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 73.03 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG22 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 73.14 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 75.31 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 71.35 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 74.03 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 73.22 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 62.02 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.421 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' MET . . . . . 0.44 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 74.14 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 63.03 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.402 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.716 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 72.01 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 75.2 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . 0.411 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 75.21 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.716 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 74.2 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 74.12 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 . . . . . 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -1.836 0 CA-C-O 120.774 0.321 . . . . 73.14 110.755 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 72.31 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.624 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 74.13 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 74.11 111.128 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 64.45 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 74.24 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.51 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 75.21 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 71.23 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 73.12 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 73.11 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 74.21 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 75.21 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 75.22 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 74.45 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.583 ' CG2' ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 70.34 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 74.42 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 75.14 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 74.22 110.769 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.462 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.44 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 75.33 110.623 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 52' ' ' THR . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.55 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 73.15 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.527 HD22 ' O ' ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 74.04 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 11.1 m120 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 75.43 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 73.15 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.416 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 74.25 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 71.2 110.881 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.565 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 74.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.52 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.11 108.153 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 70.21 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.24 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 64.32 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 73.11 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 64.43 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 70.1 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.455 ' HE1' ' O ' ' A' ' 90' ' ' ASN . 56.3 t-80 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.436 ' HZ2' ' CD ' ' A' ' 118' ' ' GLU . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.912 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 54.34 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 73.32 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.455 ' O ' ' HE1' ' A' ' 79' ' ' HIS . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 75.35 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 72.44 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 75.5 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 75.0 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 74.35 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 74.4 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.447 ' O ' HG22 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 74.5 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 73.04 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 75.1 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.476 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 54.12 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.507 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 72.22 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 74.41 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 74.52 112.021 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 72.24 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.41 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 74.52 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 74.34 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.584 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.444 HG21 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 72.43 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.584 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 74.45 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 75.23 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.412 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 71.13 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.416 ' HA ' HG13 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 72.13 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.435 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 74.33 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' SER . . . . . 0.564 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 62.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 75.53 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 61.04 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.564 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 75.43 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 75.31 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.416 HG13 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 74.5 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.417 HD11 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 74.33 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 74.33 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.31 109.057 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.459 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.427 ' O ' HG21 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 73.32 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 74.32 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.459 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 75.01 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . 0.624 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 63.21 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 75.25 110.763 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.43 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 74.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.33 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 75.41 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.14 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 75.45 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 73.01 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 74.42 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 71.2 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.437 ' HA ' HG23 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 75.11 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . 0.437 HG23 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 75.34 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.413 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.54 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 74.01 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.455 HG21 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.45 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.455 ' SD ' HG21 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 73.21 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 74.13 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 72.33 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 74.1 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 72.23 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 74.23 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 60.5 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 . . . . . 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.794 0 N-CA-C 109.212 -0.662 . . . . 72.24 109.212 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.401 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 71.12 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.454 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 75.12 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 75.45 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 72.21 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 75.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 75.32 108.945 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.518 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 60.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 72.21 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 73.52 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.567 HG23 ' CZ2' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.649 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 71.32 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 65.54 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' HA ' HG21 ' A' ' 56' ' ' VAL . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.52 109.897 -175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 63.45 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' A' ' 53' ' ' ASP . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 74.45 112.237 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 72.42 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 74.1 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.577 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 72.35 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.404 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 65.31 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 73.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 74.2 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 74.52 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.46 ' O ' HD11 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.413 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.33 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 68' ' ' GLU . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 73.21 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 74.04 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 74.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 75.12 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 73.52 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 74.14 111.505 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.32 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 75.44 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.2 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 74.54 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 74.2 107.301 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 72.12 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 75.24 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.518 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 50.12 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 73.15 111.418 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.649 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 72.22 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.495 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 71.41 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 65.31 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.499 ' O ' HG21 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 75.0 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.541 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 74.31 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.532 ' HA ' ' ND2' ' A' ' 189' ' ' ASN . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.478 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 64.15 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.43 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 74.23 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 72.04 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 61.24 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.403 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 64.15 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.495 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 70.15 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.592 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 74.34 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 74.41 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.592 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 64.03 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 74.22 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 73.34 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 63.11 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 63.22 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 74.43 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 72.12 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 74.32 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.23 109.389 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 71.53 112.594 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.531 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 71.01 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.531 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.33 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 71.5 109.727 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 75.13 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 74.31 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 75.31 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 44.31 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 62.44 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 73.32 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 73.31 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 64.53 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 142' ' ' ILE . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 70.33 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . 0.415 ' O ' HG21 ' A' ' 175' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 74.41 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 70.41 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 73.05 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.471 ' O ' HD12 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 74.13 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.44 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.471 HD12 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 75.13 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 70.31 111.136 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.521 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 75.54 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' MET . . . . . 0.457 ' HA ' HG23 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.41 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 63.24 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 192' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . 0.532 ' ND2' ' HA ' ' A' ' 113' ' ' SER . 28.1 t-20 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 70.5 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 74.42 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 73.34 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.43 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 75.32 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 74.24 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 75.42 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 74.43 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 74.34 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 74.42 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 72.1 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 74.04 110.8 176.746 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 120.743 0.306 . . . . 73.51 111.053 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 64.04 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 74.15 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 75.53 110.459 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 72.33 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.417 ' O ' ' HB1' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 75.42 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.474 HD23 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.44 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 72.53 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.513 ' CG2' ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 64.25 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 73.2 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.676 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 14.0 m120 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 73.25 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 74.41 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.459 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 74.53 112.397 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 74.51 108.039 173.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 75.22 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 74.25 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 74.32 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.54 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 62.5 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 72.2 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 75.54 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.521 HD12 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 73.23 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 75.43 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 73.51 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 64.42 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 63.04 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 75.41 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 74.02 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.43 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.41 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.479 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 60.42 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 72.44 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 74.31 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 74.4 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 64.04 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 73.23 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.407 ' N ' HD21 ' A' ' 98' ' ' ASN . 0.8 OUTLIER -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 62.44 111.26 -177.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.676 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 75.52 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 74.45 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 62.51 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 54.2 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.581 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 75.54 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.469 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 65.05 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 72.23 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 74.42 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.418 HG21 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 75.34 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 70.33 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 75.45 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 75.44 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.415 HD21 HG23 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.445 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 75.11 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.45 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 73.41 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.46 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 75.02 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.65 ' O ' HG13 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 73.22 107.694 171.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 72.41 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.42 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 65.33 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 73.32 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 75.03 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 73.33 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 72.41 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 74.24 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 73.13 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 65.55 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HB2' HD11 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 74.32 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 74.23 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 75.03 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 73.43 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.33 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 75.52 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.405 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 72.44 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 75.2 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 72.34 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.479 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 75.22 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . 0.449 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 74.41 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 73.23 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 72.23 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.43 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . 0.415 HG23 HD21 ' A' ' 119' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 53.42 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 74.22 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 74.24 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 72.34 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 73.12 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 72.22 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 71.5 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 74.22 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 65.14 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 65.43 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 74.35 109.351 178.696 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB1' ' NE2' ' A' ' 30' ' ' GLN . . . . . . . . 0 N--CA 1.43 -1.429 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.51 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 73.34 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.507 HD13 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.34 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.51 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 73.53 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 74.52 108.977 176.177 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.463 HD12 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 73.31 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 74.22 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 75.23 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 73.34 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.731 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 51.34 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 74.53 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 75.54 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 72.25 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.521 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 75.35 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 72.24 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.649 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 70.11 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 72.14 110.276 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 65.44 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.423 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . 0.262 0.9 OUTLIER 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 71.34 113.274 -175.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 71.13 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.52 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 75.4 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 71.52 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 51.45 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.456 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 74.02 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 72.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.731 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 64.54 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.24 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.463 ' HE2' HD12 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 73.11 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 74.31 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 64.1 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 74.44 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 75.43 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 73.54 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.402 ' O ' HD12 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 73.35 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.649 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 75.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 75.15 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 74.4 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.451 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 62.02 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 72.43 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.47 ' O ' HG21 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 71.25 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.54 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 62.22 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 72.11 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 75.01 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 73.44 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.524 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 72.02 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.465 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 74.0 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 73.23 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.465 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 75.31 110.862 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.662 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 74.12 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.33 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 71.32 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 74.24 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.46 ' CD1' HG23 ' A' ' 142' ' ' ILE 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 74.33 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.411 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 65.45 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 60.33 109.46 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 63.32 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 73.55 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 75.52 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 63.25 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 74.34 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.46 HG23 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 71.12 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 73.03 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.51 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.415 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.451 ' O ' HG21 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 73.35 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.662 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 151' ' ' ASN . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 71.22 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . 0.507 ' ND1' HD13 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 61.41 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.532 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.532 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 75.24 110.084 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 75.04 111.278 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 75.43 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.41 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 74.4 111.735 -177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 54.41 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.48 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.54 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 75.4 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 75.14 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . 0.55 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 72.45 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.42 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.55 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 74.24 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . 0.423 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 73.34 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 75.22 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 73.02 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 205' ' ' GLU . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.409 177.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 62.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 201' ' ' LYS . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 70.23 110.434 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 75.15 111.172 -177.607 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 N-CA-C 109.876 -0.416 . . . . 62.32 109.876 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' ILE . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.403 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 73.52 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 55.32 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 64.42 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.45 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 73.0 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 60.1 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 73.43 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 73.02 108.562 173.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 74.21 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 74.25 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 74.51 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.54 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 75.24 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 73.15 109.882 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.3 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.424 ' HA ' HG23 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 64.33 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 73.1 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 74.24 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.444 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 72.12 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.512 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 74.21 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.532 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.3 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 70.03 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 73.44 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 61.43 111.464 178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.444 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 71.32 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 74.15 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 74.51 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 72.41 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 73.54 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 73.43 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 72.22 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 74.13 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 73.42 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 75.55 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 72.5 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 74.35 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.4 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 63.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.22 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 75.02 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.507 ' HG3' HG23 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 74.31 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.509 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.455 ' O ' HG21 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.23 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.695 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 74.3 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 74.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 72.44 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 72.53 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 75.33 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 73.12 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' SER . . . . . 0.446 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.446 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 75.32 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 72.44 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.475 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 74.12 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 73.34 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 60.41 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 74.44 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.401 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 74.41 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 75.22 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 64.25 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 74.03 109.573 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.632 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 74.3 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 64.35 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.475 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 74.03 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 72.44 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 61.51 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 73.15 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 70.23 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.425 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 73.22 107.905 -178.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 71.23 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 74.32 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 75.05 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 73.3 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 74.23 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.435 ' H ' HG21 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 73.21 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 73.54 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.54 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 71.33 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 74.45 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 74.53 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 73.45 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 63.42 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 72.2 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 70.41 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' MET . . . . . 0.434 ' HA ' ' HE3' ' A' ' 185' ' ' MET . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 65.44 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 73.12 110.038 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 64.43 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 73.22 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.695 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 74.11 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 74.51 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 74.2 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 74.21 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 75.05 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 72.52 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 74.42 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 75.54 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.498 0.666 . . . . 74.24 111.643 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 75.43 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 65.32 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.46 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 74.12 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 63.14 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 74.22 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 73.43 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 73.41 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 74.35 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 74.41 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 74.34 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 72.21 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.49 HG23 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.32 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.34 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 74.4 113.849 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 72.24 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 14.8 m120 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 70.34 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 75.52 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 72.03 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 73.32 112.482 -173.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.462 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 61.5 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 70.3 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 72.14 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 74.42 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 73.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 73.21 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.498 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 72.44 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 73.42 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.409 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.498 ' HZ2' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 74.33 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 73.25 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.451 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 63.54 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 61.21 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 73.54 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 62.11 110.449 -176.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 71.34 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 63.55 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 74.51 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 71.23 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.697 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 73.45 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 61.44 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 63.12 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 73.44 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 73.25 111.631 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 72.43 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 72.33 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 71.11 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.439 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 73.21 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 73.32 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.498 ' CD ' ' HZ2' ' A' ' 82' ' ' LYS 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.615 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 72.53 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 64.3 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 63.44 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 74.41 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 71.03 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.439 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 73.14 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 72.43 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.45 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 73.34 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 70.54 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 73.43 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 70.32 111.495 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 71.35 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 71.23 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 74.33 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.615 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 74.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 63.11 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.31 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 70.03 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.46 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 73.4 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.418 ' H ' HD22 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.431 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 74.14 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.22 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.24 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 75.54 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.41 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 72.44 110.906 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 73.35 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 64.33 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.41 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 73.04 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 73.14 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.437 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 73.34 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 74.44 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 73.55 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 74.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 65.52 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 62.44 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 71.22 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . 0.455 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 72.42 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 74.32 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 72.32 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 62.23 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 70.34 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 . . . . . 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 74.0 110.104 178.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.22 0 N-CA-C 108.71 -0.848 . . . . 65.54 108.71 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 65.1 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 73.05 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.13 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.408 HG21 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 75.34 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.459 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 53.11 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 72.33 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 75.0 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 65.55 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 72.24 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 75.52 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.464 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.51 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.488 HG23 ' CZ2' ' A' ' 50' ' ' TRP . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 75.55 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 64.31 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 74.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.531 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.43 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 73.14 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 75.14 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 74.22 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 0.8 OUTLIER 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 75.1 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 63.22 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 61.0 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 75.43 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.568 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 74.42 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 72.53 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 73.3 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.464 ' HG2' ' OH ' ' A' ' 38' ' ' TYR . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 74.52 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.417 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 74.41 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CZ ' HG21 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.55 ' O ' HG21 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 73.44 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.459 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 74.53 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.35 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 72.23 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.45 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.561 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 73.41 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 72.25 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.531 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 73.13 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 75.43 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 63.52 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 70.33 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 75.53 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.443 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 73.15 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.568 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 71.31 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 75.01 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 75.41 110.045 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 75.15 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.32 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 74.31 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 74.25 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.409 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 75.25 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 75.41 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 73.21 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.447 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 75.23 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.475 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 72.34 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.475 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 74.51 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.516 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 55.51 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 73.25 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 63.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.516 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 74.2 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 70.12 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.41 108.169 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . 0.503 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.545 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 74.53 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 74.35 111.362 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.484 ' O ' HG21 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 74.54 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.439 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 74.44 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 75.51 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . 0.604 ' ND1' HD13 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 73.42 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 74.24 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 73.11 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.561 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . 0.545 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.457 ' H ' HG21 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 65.3 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 75.21 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 75.44 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 62.53 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.447 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 71.35 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 74.42 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . 0.425 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 73.22 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . 0.479 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . 0.547 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 74.45 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 75.42 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 72.44 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.51 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 75.42 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . 0.46 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 73.52 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' THR . . . . . 0.421 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 75.52 108.762 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 . . . . . 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 74.32 111.754 179.024 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.948 0 CA-C-O 121.341 0.591 . . . . 63.34 110.903 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 74.44 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 71.42 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 73.05 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.44 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 72.13 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 73.24 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 71.35 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 73.15 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 73.42 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 74.15 110.372 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 73.11 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 72.23 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 62.13 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 75.04 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.25 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.494 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 72.23 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 72.33 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.535 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 74.3 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.424 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.458 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 75.4 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 74.32 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.408 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 74.31 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 74.24 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 65.35 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.458 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.53 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.404 ' O ' HD12 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 72.22 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 71.24 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 74.54 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.43 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 75.32 109.087 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.686 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 63.13 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 75.03 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 75.22 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 73.43 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.466 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 74.44 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 75.33 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.483 ' O ' HD11 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 75.23 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 63.14 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 64.24 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 75.32 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.466 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 75.4 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 64.31 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 61.25 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 71.01 106.881 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 73.41 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.34 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.704 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 73.25 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.448 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.46 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 61.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.51 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.44 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 75.44 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 64.21 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.5 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.419 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 64.33 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 72.34 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.571 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 74.43 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 74.41 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' SER . . . . . 0.571 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 74.23 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.22 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 73.4 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.24 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 65.02 109.435 -172.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 73.1 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 72.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.432 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 72.32 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 72.45 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 74.45 108.042 173.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 72.12 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 74.54 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . 0.519 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 75.51 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 71.52 110.322 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 62.33 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 75.01 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.44 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.447 ' O ' HG21 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 75.04 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 74.4 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.414 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.44 ' HD1' ' O ' ' A' ' 150' ' ' THR . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 75.13 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 72.1 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 71.11 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . 0.577 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 74.52 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . 0.577 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 73.3 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . 0.519 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 71.34 107.918 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . 0.448 ' O ' HG21 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 75.43 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 71.44 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 71.4 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 64.12 111.222 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 75.12 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.442 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 72.3 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . 0.414 ' N ' HD11 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.44 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 71.44 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.479 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 74.25 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . 0.477 ' HA ' HG21 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 75.32 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . 0.408 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . 0.477 HG21 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 75.55 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 72.12 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 64.04 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 74.25 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 . . . . . 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.408 -2.57 0 N-CA-C 109.447 -0.575 . . . . 73.44 109.447 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.44 110.228 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 73.21 111.518 -174.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 72.03 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 75.21 111.089 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.444 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 75.22 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.14 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 75.21 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 74.01 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 72.41 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 75.53 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 63.13 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.562 HG21 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 64.25 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 74.33 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.562 ' CZ2' HG21 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 75.34 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 75.32 107.688 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HA ' HG23 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.549 ' O ' HD12 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 53' ' ' ASP . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 75.32 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 75.25 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 64.21 113.788 -172.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.416 ' O ' HG23 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.33 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.45 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 72.24 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.54 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.34 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.24 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 71.22 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 60.14 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 71.15 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 74.22 112.699 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 74.41 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 75.23 110.288 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 73.44 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.446 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 73.33 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 73.1 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 73.25 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 64.23 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 74.3 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 72.42 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.54 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 74.1 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 75.25 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 74.33 114.883 -175.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 55.3 112.019 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 73.54 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.487 ' O ' HG21 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.447 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 74.42 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 73.53 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 71.22 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 74.51 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.591 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 75.32 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 75.51 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.14 111.423 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 70.14 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 74.42 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 74.33 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.467 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.12 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.489 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.489 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 74.24 109.353 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 75.34 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.451 ' HA ' HG13 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 73.01 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.55 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 75.4 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' THR . . . . . 0.55 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.451 HG13 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 62.2 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 75.45 110.244 177.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 74.32 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . 0.478 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 73.32 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 71.11 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ASN . . . . . 0.441 ' O ' HG21 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.43 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' TRP . . . . . 0.467 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 74.5 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 62.4 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 53.1 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.41 111.42 -176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . 0.444 ' HB3' ' CG ' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 75.13 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' GLU . . . . . 0.444 ' CG ' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' ASN . . . . . 0.446 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 75.14 107.535 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 73.03 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 73.35 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 55.11 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 71.14 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.51 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ASN . . . . . 0.407 ' HA ' HG13 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 72.15 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 73.21 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 73.35 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' VAL . . . . . 0.407 HG13 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 75.3 108.466 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 75.24 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 72.44 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' ILE . . . . . 0.582 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 72.51 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' MET . . . . . 0.582 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 62.44 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 72.43 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 74.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.45 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' TRP . . . . . 0.452 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 74.43 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 74.5 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 72.34 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 . . . . . 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.241 0.643 0 N-CA-C 111.844 0.313 . . . . 71.44 111.844 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -75.86 -34.11 60.03 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.901 0.704 . . . . 74.44 112.901 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -164.47 -161.97 14.56 Favored Glycine 0 CA--C 1.477 -2.292 0 C-N-CA 120.279 -0.962 . . . . 74.14 110.93 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.9 mt -84.22 109.97 18.22 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.992 0 N-CA-C 106.405 -1.702 . . . . 74.22 106.405 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -130.16 120.62 24.85 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.94 -0.704 . . . . 73.03 110.999 -175.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -122.78 -98.45 1.41 Allowed Glycine 0 N--CA 1.417 -2.62 0 N-CA-C 109.077 -1.609 . . . . 60.14 109.077 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.1 t -154.07 108.49 3.05 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.958 -1.127 . . . . 75.43 107.958 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -81.19 105.83 12.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.799 -178.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -134.13 159.15 41.72 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 109.63 -0.507 . . . . 73.3 109.63 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -87.55 145.79 26.07 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.174 -1.417 . . . . 72.11 107.174 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.27 -13.55 37.83 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.653 0.612 . . . . 74.24 112.653 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -110.81 158.31 18.82 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.105 0.478 . . . . 75.22 110.06 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -112.87 110.06 19.91 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 107.218 -1.401 . . . . 74.44 107.218 174.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -74.07 -48.49 29.45 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.118 -0.946 . . . . 75.33 110.406 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.7 m -76.08 102.48 5.71 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.16 -0.927 . . . . 51.14 111.653 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 64.5 t -103.05 100.85 11.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.648 -1.241 . . . . 73.33 107.648 174.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.7 t -74.06 102.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 108.758 -0.83 . . . . 74.24 108.758 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.85 153.57 23.95 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.779 -0.646 . . . . 71.2 110.066 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.79 103.68 0.88 Allowed Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.129 -0.789 . . . . 63.24 111.129 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.29 112.69 20.53 Favored 'General case' 0 N--CA 1.425 -1.72 0 N-CA-C 109.922 -0.399 . . . . 74.42 109.922 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.1 t -78.79 116.48 19.16 Favored 'General case' 0 N--CA 1.419 -2.013 0 N-CA-C 108.198 -1.038 . . . . 71.03 108.198 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.9 m -69.19 111.13 4.93 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.355 -0.839 . . . . 61.13 111.945 -176.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 63.4 t -77.51 110.49 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 107.129 -1.434 . . . . 75.3 107.129 174.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 75.05 109.96 0.07 Allowed 'General case' 0 C--O 1.248 0.975 0 C-N-CA 125.422 1.489 . . . . 73.04 109.054 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.34 170.32 16.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.964 -0.562 . . . . 74.22 109.701 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.34 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.536 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 74.31 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 73.32 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.476 ' HB ' ' CE2' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 72.53 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 72.23 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 73.24 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 74.02 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 75.42 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 75.02 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.416 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 75.32 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 65.54 111.997 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 72.11 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 71.22 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 60.13 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 74.33 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.46 HG22 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 72.11 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.696 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 73.44 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 72.22 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 72.02 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.598 ' O ' HD21 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 73.11 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 65.52 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.652 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 64.23 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.42 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 73.42 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 55.32 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.401 HG13 HG22 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 65.54 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.476 ' CE2' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 71.33 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 74.33 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 74.32 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 75.11 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.421 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.411 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 72.41 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 75.54 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.421 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 73.24 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 73.23 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 61.4 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 71.21 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 72.32 105.956 175.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.416 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 54.41 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.696 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 73.41 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 73.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 73.34 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 74.13 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.415 ' O ' HG22 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 70.33 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 72.22 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 74.03 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.464 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 73.43 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.608 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 75.2 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 70.3 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 73.14 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.507 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 74.42 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.536 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 72.2 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.509 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.456 ' HA ' HG13 ' A' ' 126' ' ' ILE . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 74.21 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 63.5 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.488 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 74.52 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 122' ' ' LEU . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.442 ' N ' HD13 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 74.31 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.465 ' HE1' HG23 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 75.21 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.25 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 74.32 108.814 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 74.3 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 74.51 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 61.13 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.52 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 73.3 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 72.5 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.31 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 75.12 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.578 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.52 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 74.43 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.488 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.417 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 74.45 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 74.4 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 73.24 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 71.45 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 73.43 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.411 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 72.53 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . 0.578 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 71.33 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 72.42 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 74.24 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 64.13 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 74.22 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 71.34 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . 0.45 HG13 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 74.15 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 71.04 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 73.12 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 74.12 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 74.12 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.419 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.401 HG22 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.54 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.608 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 74.14 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 75.31 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 71.11 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . 0.452 ' CG ' ' HZ1' ' A' ' 201' ' ' LYS . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.52 108.795 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 74.42 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 75.23 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . 0.452 ' HZ1' ' CG ' ' A' ' 197' ' ' ASP . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 64.24 110.412 174.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -66.46 -35.18 79.64 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.18 -47.8 78.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.792 -0.818 . . . . 73.41 108.792 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.04 -40.44 94.78 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.908 -0.587 . . . . 75.22 109.761 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.3 ttt -63.65 -40.38 96.72 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.468 -0.787 . . . . 64.33 111.2 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.4 mmt -77.21 -26.67 52.99 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.754 -0.778 . . . . 73.52 112.118 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.83 19.19 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.162 0.506 . . . . 60.12 110.637 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -85.99 -43.21 13.35 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 113.409 0.892 . . . . 64.14 113.409 -175.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.81 -48.76 5.34 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.638 -0.505 . . . . 72.13 109.638 -172.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -79.77 173.85 55.09 Favored Glycine 0 N--CA 1.424 -2.161 0 CA-C-N 115.463 -0.79 . . . . 65.15 113.581 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 8.8 tt -139.57 113.1 6.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.751 -1.203 . . . . 74.42 107.751 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 108.34 0.72 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.649 -0.705 . . . . 75.1 111.504 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -88.27 -159.27 34.56 Favored Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.871 -0.604 . . . . 75.14 112.372 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -79.21 86.9 4.95 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.484 0.659 . . . . 62.25 111.206 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . 0.422 ' HZ3' ' HB2' ' A' ' 219' ' ' LYS . 10.3 mtmp? -124.29 160.52 27.84 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.414 -0.812 . . . . 75.43 109.852 176.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -140.55 -78.77 0.06 OUTLIER Glycine 0 N--CA 1.422 -2.263 0 N-CA-C 108.452 -1.859 . . . . 75.12 108.452 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -162.45 140.04 8.32 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.562 -0.903 . . . . 72.14 108.562 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -99.49 152.81 19.59 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.303 -1.369 . . . . 74.32 107.303 176.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.312 -1.038 0 CA-C-O 117.78 -1.105 . . . . 71.44 110.378 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.241 0.641 0 CA-C-O 119.822 -0.133 . . . . 61.31 110.878 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.2 m 72.79 141.49 0.06 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.346 1.058 . . . . 70.21 111.352 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.84 166.38 26.61 Favored Glycine 0 N--CA 1.424 -2.104 0 C-N-CA 120.373 -0.917 . . . . 74.21 111.091 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.2 tt -97.92 136.89 27.14 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 108.975 -0.75 . . . . 74.32 108.975 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -159.95 140.47 11.96 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 110.142 -0.318 . . . . 73.33 110.142 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 101.03 83.02 1.71 Allowed Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 120.707 -0.759 . . . . 71.23 112.513 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.8 m -115.04 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 107.808 -1.182 . . . . 73.42 107.808 176.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -134.73 101.21 4.85 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.995 -0.548 . . . . 74.25 110.887 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.72 85.07 1.69 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 104.696 -2.335 . . . . 73.55 104.696 174.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -150.86 74.36 1.16 Allowed 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.123 -1.398 . . . . 70.14 108.624 -174.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -89.75 -57.64 2.8 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.17 -0.923 . . . . 60.12 109.258 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.0 mttp 63.55 103.06 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.603 -1.18 . . . . 74.04 110.947 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -80.35 103.01 9.92 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.327 0.584 . . . . 75.54 110.154 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.61 -51.51 69.11 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.09 -1.414 . . . . 64.22 110.555 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m 47.55 81.31 0.04 OUTLIER 'General case' 0 C--O 1.243 0.749 0 N-CA-C 114.937 1.458 . . . . 75.42 114.937 174.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.2 t -113.06 101.15 12.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.127 -1.064 . . . . 75.45 108.127 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.9 t -113.62 101.2 12.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-N 115.742 -0.663 . . . . 72.44 109.69 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -107.98 117.71 34.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.712 -1.218 . . . . 65.21 107.712 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.31 54.22 0.54 Allowed Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 111.179 -0.768 . . . . 62.14 111.179 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.42 99.72 2.05 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 121.555 0.693 . . . . 71.14 110.835 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.6 m -117.1 156.89 26.83 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 106.585 -1.635 . . . . 73.01 106.585 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.9 m -67.65 95.83 0.51 Allowed 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 121.393 0.616 . . . . 63.25 110.133 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.4 m -95.63 14.06 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 124.087 1.898 . . . . 75.55 109.773 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -131.48 107.54 8.96 Favored 'General case' 0 C--N 1.25 -3.751 0 N-CA-C 100.79 -3.781 . . . . 73.43 100.79 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.63 165.94 20.62 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 115.473 -0.785 . . . . 75.14 111.327 -169.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.432 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 74.45 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.21 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 75.45 109.33 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 27' ' ' LEU . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.52 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 74.4 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 74.21 110.926 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 73.22 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.533 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 74.41 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 71.35 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 73.33 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 75.1 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 74.31 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.479 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 74.23 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 73.25 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.583 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.411 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 75.43 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.658 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 75.12 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.428 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 63.33 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.3 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 62.32 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 71.45 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 71.33 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 73.53 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 74.22 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 65.2 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 72.02 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 64.32 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.533 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 64.41 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.401 ' O ' HG22 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.15 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 73.13 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 72.31 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 72.31 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 73.23 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 74.42 110.411 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 74.44 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 74.34 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.583 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 75.32 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 62.34 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 71.52 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.508 ' O ' HG22 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 71.45 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 73.44 110.949 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.52 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 74.32 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.463 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 73.4 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 74.25 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 75.53 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 74.42 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.41 HD23 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 65.14 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 75.43 111.193 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 74.42 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.52 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.587 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.518 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 75.32 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.485 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 74.13 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 72.23 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 70.01 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.5 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 73.13 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 74.51 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 75.14 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 75.24 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 75.3 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.535 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 72.02 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 74.4 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.535 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.418 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 73.15 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.474 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.45 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 74.55 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 65.2 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 64.05 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 73.03 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 75.44 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 72.31 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 75.11 110.938 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 73.14 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . 0.448 HD11 HG22 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 75.5 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 75.2 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 75.31 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . 0.404 ' O ' HG22 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 72.41 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . 0.41 HG21 HD23 ' A' ' 122' ' ' LEU . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.55 113.144 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 71.45 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.33 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.431 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 53.24 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.431 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 73.14 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 73.02 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 71.45 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . 0.473 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 75.44 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 74.22 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 -75.57 -29.19 59.25 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.55 111.576 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.58 -39.68 64.46 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.489 -0.484 . . . . 70.12 111.0 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.96 84.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.603 -0.517 . . . . 73.41 109.603 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.4 ttt -61.17 -39.68 91.03 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.296 -0.866 . . . . 73.53 110.784 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.563 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 22.1 ttt -71.01 -39.46 72.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.855 -0.611 . . . . 74.53 110.153 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.9 -38.6 79.69 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 116.119 -0.491 . . . . 70.02 110.576 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -23.32 64.22 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 75.44 111.396 177.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -70.95 -46.27 62.71 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.653 -0.499 . . . . 74.53 109.653 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 131.41 -30.66 3.26 Favored Glycine 0 CA--C 1.502 -0.767 0 C-N-CA 120.653 -0.784 . . . . 72.23 111.706 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' A' ' 210' ' ' MET . 2.5 mp -98.34 117.35 43.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 N-CA-C 107.748 -1.204 . . . . 72.43 107.748 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 28.1 t -103.18 166.33 10.5 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.503 -0.925 . . . . 75.22 108.503 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -155.13 173.74 33.38 Favored Glycine 0 N--CA 1.427 -1.911 0 N-CA-C 110.906 -0.878 . . . . 74.01 110.906 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -137.56 142.47 41.36 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 109.927 -0.397 . . . . 73.41 109.927 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -152.5 103.9 2.86 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.058 0.456 . . . . 75.35 110.78 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -123.67 147.75 16.67 Favored Glycine 0 C--N 1.288 -2.104 0 N-CA-C 107.298 -2.321 . . . . 75.3 107.298 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.84 106.53 8.57 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 118.386 1.093 . . . . 73.24 112.231 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -85.56 -29.81 23.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 105.243 -2.132 . . . . 63.1 105.243 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 N--CA 1.431 -1.419 0 N-CA-C 104.734 -2.321 . . . . 75.24 104.734 173.539 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.438 -1.069 0 N-CA-C 109.552 -0.536 . . . . 72.3 109.552 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -82.85 161.93 21.77 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 116.076 -0.511 . . . . 71.25 110.866 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.25 171.04 33.97 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.126 -1.19 . . . . 62.01 110.126 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.96 118.99 2.31 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 N-CA-C 108.223 -1.028 . . . . 74.25 108.223 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -103.32 113.24 26.58 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 104.689 -2.337 . . . . 64.11 104.689 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -111.41 41.36 2.26 Favored Glycine 0 N--CA 1.432 -1.574 0 C-N-CA 119.704 -1.236 . . . . 72.5 115.116 -171.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.1 t -73.97 97.2 2.78 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.593 -1.262 . . . . 72.14 107.593 172.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -108.74 123.11 48.49 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 121.758 0.79 . . . . 63.43 111.451 -174.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -115.01 140.24 49.21 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 106.618 -1.623 . . . . 75.31 106.618 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.18 165.72 22.14 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 120.16 -0.616 . . . . 64.5 110.124 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -46.04 -57.65 4.26 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 115.977 1.843 . . . . 71.53 115.977 -170.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 61.87 173.36 0.12 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.266 0.839 . . . . 71.32 113.266 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.05 138.07 0.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.2 1.4 . . . . 74.11 107.655 170.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.97 -56.16 3.83 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.477 -0.934 . . . . 72.25 108.477 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -168.44 120.5 0.82 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.305 -1.369 . . . . 72.45 107.305 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.9 t -84.19 97.99 5.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.085 -1.079 . . . . 73.33 108.085 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -82.14 137.32 21.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-N 115.625 -0.716 . . . . 71.32 109.534 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -134.27 147.03 50.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.796 -0.816 . . . . 70.34 108.796 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.449 ' N ' ' HA3' ' A' ' 220' ' ' GLY . . . 63.97 49.21 69.0 Favored Glycine 0 N--CA 1.45 -0.426 0 O-C-N 123.866 0.729 . . . . 61.21 113.014 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.6 102.98 3.89 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.14 0.495 . . . . 63.55 110.646 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.7 t -166.68 171.8 11.22 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 108.503 -0.925 . . . . 73.14 108.503 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -83.34 88.01 6.96 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-O 121.297 0.57 . . . . 65.12 109.67 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.406 ' O ' ' HB3' ' A' ' 24' ' ' GLU . 48.4 t -83.23 106.78 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 107.525 -1.287 . . . . 74.52 107.525 175.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 23' ' ' VAL . 34.4 tt0 75.29 126.01 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 O-C-N 124.903 1.377 . . . . 71.13 110.886 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.62 174.99 3.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.925 -0.58 . . . . 75.3 110.459 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 74.43 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.543 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 75.0 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.531 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 71.44 109.374 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 73.41 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 75.41 111.817 -174.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 72.23 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.495 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 70.45 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.424 HD23 ' O ' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.501 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.668 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.511 ' O ' HG21 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 63.33 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 74.54 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.41 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 73.11 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 73.2 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 74.44 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.421 ' O ' HG21 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.42 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 64.41 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 74.44 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.41 110.767 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 75.33 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 75.02 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 74.54 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 74.35 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.427 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.531 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 74.44 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 75.32 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 72.23 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 71.41 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 70.33 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 75.22 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.5 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.495 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 64.04 111.376 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.668 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.34 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 73.43 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 43.33 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 71.31 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 72.22 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.521 ' O ' HG22 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.5 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.35 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.521 HG22 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 73.31 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 70.3 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.645 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 73.03 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 74.42 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 71.22 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.645 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.478 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 73.01 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 71.04 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.478 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 75.41 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 74.24 108.749 172.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.455 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 75.35 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 124' ' ' ASN . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 73.32 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.455 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.402 ' HA ' ' CG2' ' A' ' 142' ' ' ILE . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 74.31 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 74.31 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 71.34 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 73.13 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 75.35 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 74.41 108.727 172.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.402 ' CG2' ' HA ' ' A' ' 130' ' ' LYS . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.417 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 72.41 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 74.32 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 74.22 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 74.12 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.543 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 62.11 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.435 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 73.14 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 74.02 109.525 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . 0.417 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 74.42 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 73.3 110.814 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.427 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 75.25 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 74.33 109.468 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 74.21 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.52 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 74.21 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.493 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 71.52 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 74.42 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 74.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 74.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 73.04 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . 0.436 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 71.04 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 75.21 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 73.33 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -63.56 -45.13 91.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.3 -41.61 96.77 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.14 -0.482 . . . . 75.53 110.483 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.59 95.23 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.063 -0.517 . . . . 71.41 111.17 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -73.21 -33.02 65.13 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.419 -0.513 . . . . 73.23 110.792 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.9 ttt -70.06 -40.97 74.75 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.883 -0.599 . . . . 73.52 110.034 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.93 -18.61 62.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.758 -0.655 . . . . 64.32 111.254 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 212' ' ' GLU . 4.4 tp10 -84.02 -33.47 24.51 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.294 -0.562 . . . . 73.25 109.818 175.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 14.9 mm-40 -66.86 -50.37 62.73 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.478 -0.564 . . . . 73.5 109.478 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -161.57 -107.14 0.21 Allowed Glycine 0 N--CA 1.425 -2.078 0 N-CA-C 109.406 -1.478 . . . . 74.32 109.406 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 48.0 pt -130.96 171.96 17.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 C-N-CA 120.032 -0.667 . . . . 75.3 110.693 177.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.3 t -127.7 94.26 3.91 Favored 'General case' 0 N--CA 1.411 -2.419 0 N-CA-C 105.568 -2.012 . . . . 72.04 105.568 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -58.96 132.62 52.64 Favored Glycine 0 C--O 1.253 1.31 0 CA-C-N 115.157 -0.929 . . . . 64.15 112.322 -177.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -158.71 178.67 9.86 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.487 -1.301 . . . . 74.23 107.487 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -156.47 94.99 1.53 Allowed 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 109.413 -0.588 . . . . 72.12 109.413 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . 0.449 ' HA3' ' N ' ' A' ' 19' ' ' GLY . . . -80.94 53.38 4.6 Favored Glycine 0 C--N 1.303 -1.253 0 CA-C-N 115.664 -0.698 . . . . 54.44 113.102 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . 0.409 ' HZ3' ' C ' ' A' ' 223' ' ' ASP . 13.8 tmtt? -135.63 81.97 1.92 Allowed 'General case' 0 C--N 1.288 -2.096 0 N-CA-C 104.016 -2.587 . . . . 75.52 104.016 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -47.21 -63.38 1.06 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 113.11 -1.859 . . . . 72.44 112.542 -173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . 0.409 ' C ' ' HZ3' ' A' ' 221' ' ' LYS . 7.3 p-10 . . . . . 0 C--N 1.288 -2.093 0 N-CA-C 108.613 -0.884 . . . . 73.41 108.613 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.801 0.334 . . . . 75.32 110.104 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.1 m -157.41 147.54 20.75 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.537 -0.912 . . . . 71.2 108.537 176.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.55 160.22 21.57 Favored Glycine 0 CA--C 1.49 -1.478 0 N-CA-C 110.259 -1.136 . . . . 74.44 110.259 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.1 tt -147.04 93.43 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 CA-C-O 122.376 1.084 . . . . 71.14 112.333 -176.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -124.43 122.38 37.48 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.095 -2.187 . . . . 72.41 105.095 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.87 113.89 1.37 Allowed Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.292 -0.956 . . . . 72.32 112.075 -177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -147.42 65.67 1.13 Allowed 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 106.368 -1.716 . . . . 75.15 106.368 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 t -134.35 -169.13 2.27 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.443 -1.253 . . . . 74.4 108.429 -174.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -148.43 152.61 37.26 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.662 -0.495 . . . . 73.2 109.662 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -139.18 123.57 18.22 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 108.255 -1.017 . . . . 75.23 108.255 175.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -77.16 -48.78 16.75 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 105.118 -2.179 . . . . 73.54 105.118 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.346 41.0 mmtt 61.47 67.81 0.76 Allowed 'General case' 0 N--CA 1.418 -2.042 0 CA-C-N 112.609 -2.087 . . . . 74.52 114.439 -176.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.8 ttp180 -118.12 82.61 1.87 Allowed 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 106.756 -1.572 . . . . 73.11 106.756 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -83.61 -47.78 10.91 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.189 -1.412 . . . . 71.22 107.189 175.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m 30.29 66.52 0.13 Allowed 'General case' 0 C--N 1.347 0.482 0 O-C-N 125.656 1.848 . . . . 75.22 114.175 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.15 95.08 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.773 0 N-CA-C 107.757 -1.201 . . . . 74.21 107.757 178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.7 p -79.4 81.99 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-O 122.823 1.297 . . . . 71.34 110.514 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -123.33 97.2 5.3 Favored 'General case' 0 N--CA 1.414 -2.259 0 N-CA-C 106.044 -1.836 . . . . 61.02 106.044 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.98 40.54 0.8 Allowed Glycine 0 CA--C 1.475 -2.429 0 N-CA-C 108.945 -1.662 . . . . 74.24 108.945 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.63 139.82 50.89 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.704 -0.748 . . . . 64.52 109.395 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.1 p -108.94 165.67 11.4 Favored 'General case' 0 C--N 1.278 -2.52 0 CA-C-N 115.606 -0.725 . . . . 72.21 109.834 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.5 m -71.96 101.69 2.75 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.992 -0.744 . . . . 64.21 108.992 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.62 119.6 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 109.63 -0.508 . . . . 74.44 109.63 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 77.61 152.39 0.13 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.183 1.393 . . . . 75.14 109.876 -175.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.52 176.22 5.23 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.406 ' HB2' ' OE1' ' A' ' 29' ' ' GLU . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 64.31 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 36' ' ' GLU . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 71.24 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.33 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 74.24 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.455 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 72.43 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.429 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 74.33 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 75.42 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 73.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 75.22 111.824 -174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 74.12 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.754 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.529 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 75.22 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.484 ' O ' HG21 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.529 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 74.22 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.476 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.11 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 73.33 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 72.12 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 74.14 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 75.33 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 64.41 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.461 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.41 HD21 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 65.41 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 73.55 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.432 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 73.13 110.63 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 75.43 111.976 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 73.25 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 64.32 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.404 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 62.54 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.23 111.968 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 73.53 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 74.22 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 75.41 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.32 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 72.14 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.754 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.429 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 72.23 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.41 ' SD ' HD21 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 73.0 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 74.4 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 75.52 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.486 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 75.32 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.502 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 52.7 t-80 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 72.01 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.43 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 71.25 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.502 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 71.31 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 71.11 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 74.02 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 73.23 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.502 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 72.53 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.619 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.643 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 75.03 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 74.11 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.619 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 75.14 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 74.33 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 71.25 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 60.01 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 54.42 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.454 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 73.14 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 62.5 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.419 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 65.34 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 74.23 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.461 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 74.41 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.525 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 73.24 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.5 ' O ' HG21 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.54 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.33 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.525 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 72.01 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 73.34 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 74.25 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.415 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 74.34 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 75.42 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 72.44 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 73.1 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.404 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 70.15 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.461 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 75.34 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 75.14 111.348 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 71.04 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 75.4 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.447 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 75.25 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 74.41 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 75.42 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 72.54 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.541 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 71.32 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.541 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 74.51 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.41 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 75.01 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.498 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 71.44 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 75.24 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 75.44 110.572 -176.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 71.42 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 72.24 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 72.13 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 62.51 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 -66.19 -36.19 82.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -66.26 -46.11 78.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.378 -0.828 . . . . 73.35 109.401 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.25 -42.08 98.01 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 120.982 0.42 . . . . 74.1 111.911 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.74 -34.67 67.2 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.614 -0.434 . . . . 72.32 110.804 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 51.2 ttp -73.87 -31.02 62.95 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.378 -0.373 . . . . 72.21 110.262 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.31 -32.36 72.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.344 0.593 . . . . 74.03 110.676 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.32 -38.65 26.41 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 115.837 -0.62 . . . . 72.04 109.726 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -63.71 -41.95 98.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.694 -0.685 . . . . 53.14 111.383 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -168.78 -119.67 0.5 Allowed Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 120.979 -0.629 . . . . 73.14 111.972 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.68 142.39 21.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 108.828 -0.804 . . . . 74.51 108.828 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.8 m -120.77 175.54 5.98 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 116.6 -0.273 . . . . 75.14 110.482 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 143.84 140.89 3.71 Favored Glycine 0 N--CA 1.427 -1.913 0 N-CA-C 108.689 -1.764 . . . . 73.31 108.689 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.61 -67.97 0.43 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 117.246 0.523 . . . . 72.5 109.604 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 55.9 tptt 170.09 116.25 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 124.937 1.295 . . . . 75.03 108.055 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -78.97 85.02 1.21 Allowed Glycine 0 N--CA 1.437 -1.248 0 N-CA-C 109.354 -1.499 . . . . 64.14 109.354 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -78.78 -41.03 31.55 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.765 -0.828 . . . . 71.51 108.765 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -116.76 104.38 11.28 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.163 -0.926 . . . . 75.3 109.184 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--O 1.251 1.143 0 N-CA-C 107.659 -1.237 . . . . 74.13 107.659 179.442 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.947 -0.76 . . . . 73.22 108.947 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 p -142.13 147.28 36.41 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 110.001 -0.37 . . . . 72.12 110.001 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.47 175.46 21.2 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.314 -1.114 . . . . 63.42 110.314 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.3 tt -162.22 99.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 CA-C-O 121.956 0.884 . . . . 71.44 110.688 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.38 117.91 30.65 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.117 -0.947 . . . . 75.12 108.807 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -84.68 123.58 6.33 Favored Glycine 0 N--CA 1.432 -1.582 0 CA-C-N 116.044 -0.525 . . . . 41.23 112.487 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -133.0 86.79 2.34 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 109.337 -0.616 . . . . 72.2 109.337 177.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -153.42 115.37 4.31 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.904 -0.589 . . . . 73.35 109.951 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.8 143.7 48.71 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.86 -0.793 . . . . 75.42 108.86 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -119.79 149.69 41.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.971 -0.751 . . . . 72.35 108.971 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.54 -32.44 67.09 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.538 0.524 . . . . 75.43 112.139 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 49.62 67.54 0.88 Allowed 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.918 0.887 . . . . 72.43 111.614 -176.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.5 mtt180 -78.56 139.99 38.55 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.892 -1.049 . . . . 74.22 111.241 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -80.86 -15.19 57.0 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.898 -0.592 . . . . 72.41 110.561 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.5 m 75.8 82.43 0.1 Allowed 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.969 1.308 . . . . 72.34 111.959 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.9 p -82.02 89.6 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 CA-C-O 122.698 1.237 . . . . 70.01 108.74 176.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.87 160.34 35.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-N 114.357 -1.292 . . . . 75.33 108.742 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.38 126.94 48.22 Favored 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 107.951 -1.129 . . . . 74.13 107.951 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.28 116.81 5.26 Favored Glycine 0 C--N 1.303 -1.26 0 N-CA-C 110.718 -0.953 . . . . 75.41 110.718 -179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -104.42 132.03 51.13 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.064 0.459 . . . . 71.13 111.477 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.1 t -145.02 160.77 40.84 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 106.744 -1.576 . . . . 74.43 106.744 175.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -83.12 98.32 9.27 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 120.664 0.269 . . . . 63.25 110.456 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -79.6 119.34 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.608 0 CA-C-O 121.158 0.504 . . . . 72.42 110.411 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 66.9 96.6 0.06 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 114.731 -1.122 . . . . 73.24 111.875 -174.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.75 167.59 20.53 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 114.534 -1.212 . . . . 71.0 107.737 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.23 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.41 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 65.43 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 71.45 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 75.51 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 72.31 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' HG13 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.51 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 73.22 110.799 -177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 72.43 111.047 179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 71.1 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.3 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.41 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 74.33 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.515 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 75.15 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.603 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.44 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 74.04 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 73.24 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 73.14 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 70.51 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.414 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 74.24 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.43 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.418 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 71.31 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.647 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 74.43 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 72.12 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 55.25 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.52 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.43 109.488 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 72.04 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 75.53 111.948 174.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.455 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 75.32 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 75.11 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 64.21 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 70.33 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 75.43 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 73.12 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 75.23 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 72.02 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 65.22 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 73.3 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.603 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 71.55 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.428 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 72.12 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 74.45 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.428 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 74.44 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 74.32 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 107' ' ' SER . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 75.35 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 73.43 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 75.35 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 72.23 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.748 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.4 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 74.24 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 74.45 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 73.42 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.486 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 75.52 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 71.24 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 71.31 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.486 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 72.25 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.473 ' HA ' HG11 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.43 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 74.23 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 63.52 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 72.03 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.44 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 72.54 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.473 HG11 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 74.42 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 74.3 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.523 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 75.05 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.44 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 75.13 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 72.21 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.45 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.748 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.52 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 70.33 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 63.24 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.402 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 73.11 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 74.24 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 75.03 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 75.42 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 73.24 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 74.34 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 74.24 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 61.35 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 75.22 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 74.3 110.742 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 75.23 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 64.14 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.475 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 72.04 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.647 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.553 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 54.25 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.553 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 73.34 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 64.31 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 75.42 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' THR . . . . . 0.463 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 75.3 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 73.13 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 72.12 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 72.32 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -64.11 -46.83 82.44 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 73.52 109.57 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.23 -40.61 96.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.479 -0.328 . . . . 74.32 110.679 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.09 85.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.007 0.432 . . . . 74.22 111.279 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 49.2 ttm -69.98 -40.61 75.25 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 74.14 110.057 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 56.4 ttp -67.71 -40.98 84.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.828 -0.624 . . . . 72.3 109.776 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.78 -27.24 66.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.058 -0.519 . . . . 72.04 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -79.03 -49.06 13.3 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.896 -0.593 . . . . 70.14 109.713 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -58.16 5.59 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.255 -0.884 . . . . 63.43 112.105 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -149.08 111.04 0.51 Allowed Glycine 0 N--CA 1.425 -2.036 0 C-N-CA 120.066 -1.064 . . . . 63.1 111.539 -176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 2.7 mp -64.39 117.03 4.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.981 -0.748 . . . . 73.05 108.981 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.1 t -84.66 150.96 24.79 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 109.256 -0.646 . . . . 63.33 109.256 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -81.51 134.15 12.85 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.916 -0.874 . . . . 53.51 110.916 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -80.19 117.15 20.73 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.27 -0.641 . . . . 73.44 109.27 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -127.2 133.11 50.32 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.14 -0.689 . . . . 74.33 109.14 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 174.05 177.83 43.53 Favored Glycine 0 N--CA 1.417 -2.575 0 N-CA-C 110.513 -1.035 . . . . 71.13 110.513 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.61 148.49 25.94 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 110.11 -0.33 . . . . 71.44 110.11 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 63.1 tttp 177.19 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.725 -1.213 . . . . 73.44 107.725 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 C--N 1.318 -0.779 0 N-CA-C 107.398 -1.334 . . . . 73.32 107.398 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.429 -1.514 0 N-CA-C 109.138 -0.69 . . . . 64.05 109.138 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 p -134.72 148.15 50.22 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.451 -0.574 . . . . 74.42 109.451 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 147.3 174.52 19.38 Favored Glycine 0 N--CA 1.436 -1.302 0 N-CA-C 111.601 -0.599 . . . . 72.25 111.601 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.1 tt -131.23 109.09 15.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-O 121.9 0.857 . . . . 73.53 108.747 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -107.71 152.07 24.82 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.49 -0.777 . . . . 75.33 110.651 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.36 87.34 0.28 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.597 -0.811 . . . . 74.13 111.118 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -147.45 102.7 3.48 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.74 -0.467 . . . . 72.34 109.74 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.1 t -128.42 119.07 24.25 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.522 -0.918 . . . . 71.04 108.522 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -109.9 109.72 20.44 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.638 0.732 . . . . 64.51 110.832 -179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.22 109.3 20.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.807 -1.553 . . . . 63.34 106.807 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.24 -47.53 68.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.075 0.95 . . . . 73.14 113.552 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.3 mttm 60.34 70.05 0.65 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.89 0.876 . . . . 74.12 111.296 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -93.17 108.6 20.18 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.244 -1.021 . . . . 74.43 108.244 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.52 ' O ' HG22 ' A' ' 16' ' ' VAL . 6.5 p-10 -79.17 -6.29 56.21 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.514 0.931 . . . . 75.51 113.514 -172.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.0 m -39.48 114.89 0.45 Allowed 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 114.827 1.418 . . . . 63.43 114.827 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.52 HG22 ' O ' ' A' ' 14' ' ' ASP . 59.5 t -134.08 116.16 22.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 106.434 -1.691 . . . . 74.51 106.434 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.0 t -134.42 127.84 50.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.845 0 CA-C-O 120.611 0.243 . . . . 75.55 110.762 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -111.15 169.26 8.9 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.125 -0.694 . . . . 74.05 109.125 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.48 66.91 0.27 Allowed Glycine 0 C--N 1.303 -1.281 0 N-CA-C 111.001 -0.84 . . . . 74.44 111.001 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -139.63 136.18 34.06 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.578 -0.527 . . . . 74.54 109.578 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.6 t -175.74 153.0 1.34 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.139 -1.06 . . . . 74.21 108.139 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -104.95 82.96 1.93 Allowed 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.286 0.565 . . . . 63.24 109.969 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.6 m -100.59 57.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.364 0 CA-C-O 122.274 1.035 . . . . 75.1 111.456 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -170.8 147.9 2.83 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 106.299 -1.741 . . . . 72.41 106.299 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.4 166.63 14.69 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 72.45 110.283 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.414 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 71.12 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 74.12 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 53.43 110.187 177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 74.31 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 62.42 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 73.11 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.486 HH22 HD21 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 74.14 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 61.54 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 70.3 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.486 HD21 HH22 ' A' ' 37' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 70.24 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 74.15 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.484 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 72.35 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 70.15 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.73 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 71.4 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 73.2 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 73.22 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.43 HG22 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 74.34 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 65.14 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 75.12 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 74.44 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 75.14 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 75.32 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.659 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 63.43 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 64.12 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 64.33 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.404 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 71.33 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 74.42 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 74.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 73.23 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 65.23 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 72.33 110.828 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 75.45 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 64.33 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.444 ' CD ' ' HZ1' ' A' ' 80' ' ' LYS . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 75.24 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.25 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 62.05 110.778 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 74.13 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 62.31 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 72.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.73 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 72.33 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 65.14 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.444 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 73.2 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 73.21 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.504 ' O ' HG21 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.467 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 63.31 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 71.45 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 75.23 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 73.41 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 74.21 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 63.32 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.55 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 75.12 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 73.22 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.14 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.35 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 75.41 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 73.35 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 71.11 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 74.04 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.45 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 74.35 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 73.51 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 74.53 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.487 ' HA ' HG13 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 73.31 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 73.45 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 73.24 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 73.32 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.45 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 74.31 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 71.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 74.33 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.503 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 72.25 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 75.0 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.23 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 73.21 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.516 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 64.02 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 71.31 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 74.31 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 70.4 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . 0.414 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 52.3 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.4 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 72.22 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 75.0 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 75.13 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 74.41 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 72.32 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 74.32 109.299 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 73.03 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG22 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 73.14 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 75.31 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 71.35 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 74.03 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 73.22 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 62.02 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.421 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' MET . . . . . 0.44 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 74.14 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 63.03 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.402 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.716 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 72.01 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 75.2 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.411 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 75.21 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.716 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 74.2 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 74.12 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 -71.58 -29.87 65.2 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 52.5 tp -71.05 -43.39 67.92 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 110.242 -0.281 . . . . 51.4 110.242 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -67.17 -40.55 86.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.269 0.557 . . . . 74.02 109.824 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 46.9 ttp -69.57 -31.69 70.02 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.739 -0.664 . . . . 72.24 110.224 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 16.2 tpt -72.84 -33.91 66.45 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 109.359 -0.608 . . . . 72.24 109.359 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . 0.441 ' HA ' ' HB ' ' A' ' 215' ' ' ILE . . . -63.3 -38.38 90.92 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 122.572 0.349 . . . . 75.32 110.564 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 45.5 mt-10 -69.26 -42.61 75.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.915 -0.584 . . . . 75.45 110.751 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -66.7 -46.29 76.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 71.4 111.144 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 149.93 89.99 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 110.106 -1.198 . . . . 62.41 110.106 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . 0.441 ' HB ' ' HA ' ' A' ' 211' ' ' ALA . 7.6 tp -82.11 131.61 33.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 121.112 0.482 . . . . 75.2 109.79 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 46.1 m -84.69 102.52 13.03 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 115.828 -0.623 . . . . 61.22 110.771 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -75.75 98.92 1.21 Allowed Glycine 0 N--CA 1.43 -1.705 0 N-CA-C 109.05 -1.62 . . . . 74.33 109.05 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -77.95 101.59 6.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.172 0.51 . . . . 65.22 110.932 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -86.59 127.28 34.9 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.482 -0.933 . . . . 75.01 108.482 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -107.57 -113.11 3.7 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 119.923 -1.132 . . . . 75.55 112.359 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -168.87 -175.19 2.3 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 105.854 -1.906 . . . . 75.13 105.854 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -82.31 115.64 21.46 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 106.805 -1.554 . . . . 74.55 106.805 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.29 -1.998 0 CA-C-O 117.931 -1.033 . . . . 65.23 108.985 179.332 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.441 -0.906 0 N-CA-C 109.122 -0.695 . . . . 71.22 109.122 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -150.97 96.24 2.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 109.04 -0.726 . . . . 55.23 109.04 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.45 -179.92 30.94 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.235 -1.546 . . . . 63.43 109.235 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.8 tp -127.39 110.66 23.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 CA-C-O 121.577 0.703 . . . . 75.32 110.34 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.4 140.78 30.47 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.504 -0.771 . . . . 73.42 109.823 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.48 -36.46 0.09 OUTLIER Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 121.08 -0.581 . . . . 72.42 111.723 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -65.2 94.34 0.15 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.788 0.804 . . . . 70.41 111.716 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 m -108.64 5.17 24.68 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 122.886 1.327 . . . . 74.12 108.397 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -151.59 150.4 30.27 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 113.725 -1.58 . . . . 74.45 106.931 -175.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.49 153.72 29.39 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.63 -0.878 . . . . 73.23 108.63 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -83.73 -19.8 34.55 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 120.888 0.375 . . . . 64.34 111.074 -176.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 53.56 59.68 4.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 122.765 1.269 . . . . 74.01 111.619 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -144.36 179.81 7.01 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 105.605 -1.998 . . . . 75.24 105.605 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.27 -19.59 65.52 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.142 0.496 . . . . 73.5 110.165 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.2 m 73.82 103.8 0.07 Allowed 'General case' 0 C--O 1.243 0.755 0 C-N-CA 125.219 1.408 . . . . 73.22 111.88 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -93.2 105.86 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.884 -1.053 . . . . 74.41 110.634 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.0 t -96.92 106.61 18.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.863 0 N-CA-C 107.794 -1.188 . . . . 63.12 107.794 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.14 103.41 14.9 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.441 -1.318 . . . . 62.23 107.441 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.95 51.3 0.67 Allowed Glycine 0 N--CA 1.422 -2.29 0 N-CA-C 110.066 -1.214 . . . . 74.22 110.066 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.69 134.38 35.15 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.883 -0.414 . . . . 73.52 109.883 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -104.45 135.71 45.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.498 -0.927 . . . . 71.54 108.498 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.0 m -82.04 131.04 35.24 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.096 -0.705 . . . . 61.4 109.096 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.4 m -81.06 74.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-O 122.084 0.945 . . . . 73.02 113.331 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 178.35 161.98 0.65 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 105.796 -1.928 . . . . 75.41 105.796 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.22 148.36 45.92 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.774 0.321 . . . . 73.14 110.755 -174.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 72.31 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.624 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 74.13 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 74.11 111.128 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 64.45 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 74.24 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.51 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 75.21 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 71.23 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 73.12 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 73.11 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 74.21 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 75.21 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 75.22 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 74.45 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.583 ' CG2' ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 70.34 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 74.42 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 75.14 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 74.22 110.769 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.462 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.44 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 75.33 110.623 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 52' ' ' THR . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.55 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 73.15 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.527 HD22 ' O ' ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 74.04 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 11.1 m120 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 75.43 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 73.15 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.416 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 74.25 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 71.2 110.881 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.565 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 74.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.52 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.11 108.153 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 70.21 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.24 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 64.32 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 73.11 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 64.43 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 70.1 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.455 ' HE1' ' O ' ' A' ' 90' ' ' ASN . 56.3 t-80 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.436 ' HZ2' ' CD ' ' A' ' 118' ' ' GLU . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 74.22 110.912 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 54.34 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 73.32 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.455 ' O ' ' HE1' ' A' ' 79' ' ' HIS . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 75.35 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 72.44 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 75.5 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 75.0 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 74.35 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 74.4 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.447 ' O ' HG22 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 74.5 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 73.04 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 75.1 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.476 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 54.12 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.507 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 72.22 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 74.41 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 74.52 112.021 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 72.24 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.41 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 74.52 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 74.34 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.584 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.444 HG21 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 72.43 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.497 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.584 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 74.45 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 75.23 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.412 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 71.13 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.416 ' HA ' HG13 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 72.13 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.435 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 74.33 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.564 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 62.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 75.53 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 61.04 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.564 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 75.43 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 75.31 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.416 HG13 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 74.5 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.417 HD11 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 74.33 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 74.33 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.31 109.057 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.459 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.427 ' O ' HG21 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 73.32 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 74.32 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.459 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 75.01 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.624 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 63.21 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 75.25 110.763 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.43 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 74.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.33 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 75.41 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.14 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 75.45 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 73.01 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 74.42 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 71.2 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.437 ' HA ' HG23 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 75.11 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . 0.437 HG23 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 75.34 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.413 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.54 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 74.01 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.455 HG21 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.45 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.455 ' SD ' HG21 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 73.21 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 74.13 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 72.33 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 74.1 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 72.23 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 74.23 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 60.5 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 210' ' ' MET . 33.0 ttm180 -71.89 -34.56 69.26 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 50.8 tp -68.18 -43.6 77.78 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.307 -0.627 . . . . 75.03 109.307 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.78 -34.08 77.34 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 115.831 -0.622 . . . . 72.44 110.176 177.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 48.2 ttm -61.79 -46.67 88.55 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 123.806 0.842 . . . . 73.34 109.902 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 25.9 mmt -64.65 -37.34 87.25 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.77 -0.65 . . . . 71.11 110.834 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.66 -35.22 72.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 74.55 110.751 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -67.76 -45.62 74.38 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.4 1.08 . . . . 74.34 108.643 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -68.76 -35.65 77.35 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.175 -0.92 . . . . 74.53 109.77 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 89.85 24.48 29.94 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 110.512 -1.035 . . . . 75.34 110.512 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . 0.407 ' O ' ' HB3' ' A' ' 210' ' ' MET . 47.4 mm -127.44 117.42 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 N-CA-C 108.605 -0.887 . . . . 73.42 108.605 -176.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.8 t -90.07 90.62 8.21 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.556 -0.905 . . . . 73.54 108.556 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -139.22 49.53 0.82 Allowed Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 110.871 -0.891 . . . . 74.4 110.871 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -95.63 102.88 14.72 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.594 -0.521 . . . . 74.31 109.594 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.78 107.18 18.53 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.216 0.532 . . . . 74.32 110.207 -179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -101.97 19.83 47.91 Favored Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.526 -1.029 . . . . 74.2 110.526 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -75.04 88.86 2.41 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.575 -0.898 . . . . 73.04 108.575 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.66 -58.75 3.55 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 114.373 -1.285 . . . . 73.43 108.857 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 106.202 -1.777 . . . . 71.52 106.202 177.746 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 107.32 -1.363 . . . . 74.42 107.32 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 p -80.53 156.41 26.52 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 109.023 -0.732 . . . . 73.13 109.023 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.41 159.29 28.35 Favored Glycine 0 N--CA 1.424 -2.126 0 C-N-CA 119.314 -1.422 . . . . 74.34 112.124 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 pt -88.35 97.16 6.49 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.192 0 CA-C-O 122.254 1.026 . . . . 74.54 108.882 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -97.63 109.96 22.62 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 114.677 -1.147 . . . . 74.43 108.672 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.46 142.63 25.06 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 110.148 -1.181 . . . . 63.25 110.148 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.62 121.69 30.37 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 109.526 -0.546 . . . . 64.43 109.526 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.9 t -88.84 106.62 18.5 Favored 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.267 1.032 . . . . 70.45 108.808 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -105.3 150.75 24.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.257 -0.883 . . . . 74.2 110.965 -175.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.665 ' OD2' ' HG3' ' A' ' 12' ' ' LYS . 9.5 t70 -153.13 144.07 22.91 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 115.452 -0.795 . . . . 72.43 109.956 -176.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -83.03 -58.23 2.95 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.984 0.735 . . . . 74.31 112.984 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.665 ' HG3' ' OD2' ' A' ' 10' ' ' ASP . 62.3 mttp 55.36 60.55 3.32 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.795 0.807 . . . . 73.23 111.338 -167.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -86.57 122.56 30.67 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 107.629 -1.248 . . . . 73.44 107.629 176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -95.06 -49.71 5.41 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.239 -0.437 . . . . 73.21 111.396 -175.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.4 m 59.49 81.71 0.16 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.027 0.918 . . . . 71.12 109.752 -175.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.14 113.52 35.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 CA-C-O 121.807 0.813 . . . . 73.01 112.82 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -96.08 129.51 46.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 107.965 -1.124 . . . . 74.32 107.965 174.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -82.29 130.46 35.1 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.234 -0.654 . . . . 72.02 109.234 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.52 47.53 1.03 Allowed Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 120.697 -0.763 . . . . 74.24 112.257 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.27 138.27 31.59 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.191 -0.67 . . . . 75.41 109.191 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.0 m -147.86 143.97 27.8 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.078 -1.082 . . . . 73.13 108.078 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 23.3 m -99.39 99.56 10.5 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.022 -0.732 . . . . 62.54 109.022 176.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -79.08 129.07 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 N-CA-C 109.331 -0.618 . . . . 72.33 109.331 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 70.13 170.02 0.31 Allowed 'General case' 0 N--CA 1.436 -1.135 0 CA-C-O 121.778 0.799 . . . . 73.51 110.814 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.34 164.28 13.28 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 115.425 -0.807 . . . . 72.24 109.212 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.401 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 71.12 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.454 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 75.12 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 75.45 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 72.21 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 75.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 75.32 108.945 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.518 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 60.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 72.21 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 73.52 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.567 HG23 ' CZ2' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.649 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 71.32 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 65.54 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' HA ' HG21 ' A' ' 56' ' ' VAL . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.52 109.897 -175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 63.45 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' A' ' 53' ' ' ASP . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 74.45 112.237 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 72.42 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 74.1 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.577 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 72.35 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.404 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 65.31 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 73.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 74.2 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 74.52 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.46 ' O ' HD11 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.413 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.33 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 68' ' ' GLU . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 73.21 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 74.04 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 74.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 75.12 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 73.52 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 74.14 111.505 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.32 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 75.44 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.2 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 74.54 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 74.2 107.301 177.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 72.12 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 75.24 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.518 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 50.12 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 73.15 111.418 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.649 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 72.22 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.495 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 71.41 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 65.31 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.499 ' O ' HG21 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 75.0 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.541 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 74.31 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.532 ' HA ' ' ND2' ' A' ' 189' ' ' ASN . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.478 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 64.15 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.43 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 74.23 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 72.04 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 61.24 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.403 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 64.15 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.495 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 70.15 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.592 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 74.34 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 74.41 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.592 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 64.03 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 74.22 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 73.34 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 63.11 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 63.22 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 74.43 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 72.12 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 74.32 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.23 109.389 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 71.53 112.594 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.531 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 71.01 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.531 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.33 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 71.5 109.727 -178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 75.13 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 74.31 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 75.31 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 44.31 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 62.44 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 73.32 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 73.31 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 64.53 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 142' ' ' ILE . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 70.33 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . 0.415 ' O ' HG21 ' A' ' 175' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 74.41 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 70.41 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 73.05 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.471 ' O ' HD12 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 74.13 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.44 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.471 HD12 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 75.13 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 70.31 111.136 -177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.521 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 75.54 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' MET . . . . . 0.457 ' HA ' HG23 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.41 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 63.24 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.55 ' O ' ' HB2' ' A' ' 192' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . 0.532 ' ND2' ' HA ' ' A' ' 113' ' ' SER . 28.1 t-20 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 70.5 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 74.42 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 73.34 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.43 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 75.32 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 74.24 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 75.42 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 74.43 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 74.34 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 74.42 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 72.1 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 210' ' ' MET . 98.3 mtt180 -78.26 -32.69 49.74 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 74.04 110.8 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.4 tp -65.01 -38.0 89.49 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.105 -0.702 . . . . 74.54 109.105 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.36 82.66 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.859 -0.61 . . . . 73.44 109.507 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.2 ttt -68.07 -35.02 77.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.65 -0.705 . . . . 75.45 110.228 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.565 ' HG3' ' O ' ' A' ' 206' ' ' ARG . 65.6 mtt -68.05 -38.17 82.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.056 -0.52 . . . . 73.32 109.753 176.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.86 75.86 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.75 -0.659 . . . . 71.42 110.223 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -59.14 -44.21 92.05 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.084 0.954 . . . . 61.13 108.708 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.36 -45.68 90.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.347 -0.842 . . . . 64.44 109.338 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 135.62 -71.5 0.48 Allowed Glycine 0 N--CA 1.433 -1.561 0 N-CA-C 108.694 -1.762 . . . . 70.41 108.694 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 13.2 tt -144.14 140.3 24.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.555 -0.905 . . . . 72.31 108.555 175.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 26.5 t -131.98 -41.2 1.03 Allowed 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.132 -0.692 . . . . 63.22 109.132 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 146.32 -85.68 0.17 Allowed Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 109.786 -1.326 . . . . 73.34 109.786 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . 0.459 ' HB3' ' SD ' ' A' ' 210' ' ' MET . . . 54.66 78.54 0.17 Allowed 'General case' 0 C--O 1.243 0.745 0 C-N-CA 124.717 1.207 . . . . 73.4 113.059 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -141.89 147.67 37.48 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.385 -0.968 . . . . 65.54 108.385 178.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 146.61 123.42 1.48 Allowed Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.099 -0.8 . . . . 73.52 111.099 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -127.53 140.8 51.89 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 122.714 0.406 . . . . 74.11 110.012 -177.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -93.07 114.57 27.15 Favored 'General case' 0 C--N 1.298 -1.661 0 N-CA-C 109.07 -0.715 . . . . 73.11 109.07 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 CA--C 1.483 -1.626 0 N-CA-C 107.503 -1.295 . . . . 70.22 107.503 174.381 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 121.157 0.504 . . . . 71.33 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.2 p -154.89 149.87 26.83 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.591 -1.263 . . . . 64.3 107.591 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.67 171.76 20.69 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.814 -1.184 . . . . 61.42 112.834 -176.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.0 mt -129.33 91.92 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 108.714 -0.847 . . . . 74.41 108.714 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.42 132.07 35.83 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.655 -1.609 . . . . 74.04 106.655 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -136.68 26.48 3.03 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.381 -0.914 . . . . 65.14 113.379 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.4 t -70.91 95.49 1.17 Allowed 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.274 0.559 . . . . 73.44 110.186 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -78.61 115.3 18.22 Favored 'General case' 0 N--CA 1.426 -1.638 0 N-CA-C 106.658 -1.608 . . . . 64.43 106.658 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.25 108.42 5.77 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.806 0.669 . . . . 71.42 112.806 -172.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -122.35 105.85 10.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.448 -1.686 . . . . 73.51 106.448 171.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -84.03 -17.32 40.78 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 116.036 -0.529 . . . . 73.33 112.032 -173.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.507 ' HZ3' ' HB3' ' A' ' 12' ' ' LYS . 7.9 mtpm? 71.54 144.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.076 1.35 . . . . 74.23 111.487 -177.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -113.18 88.43 2.83 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 107.775 -1.195 . . . . 74.44 107.775 170.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.23 -7.14 50.19 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 114.473 -1.239 . . . . 75.11 113.12 -173.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.7 t 66.42 79.35 0.24 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 122.388 1.09 . . . . 74.54 109.355 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 26.4 t -101.6 115.82 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.631 0 CA-C-N 114.483 -1.235 . . . . 73.24 107.738 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.61 83.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.05 0 CA-C-O 122.562 1.172 . . . . 63.33 109.341 177.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -108.51 95.0 5.36 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.774 -1.103 . . . . 74.4 109.104 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.79 51.43 0.19 Allowed Glycine 0 N--CA 1.419 -2.446 0 N-CA-C 110.744 -0.943 . . . . 74.14 110.744 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.8 78.93 9.63 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.452 -0.944 . . . . 74.24 108.452 177.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.5 t -98.85 174.62 6.29 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-N 114.218 -1.355 . . . . 74.42 109.101 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.6 m -72.91 95.12 1.92 Allowed 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.97 -0.559 . . . . 74.14 109.624 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -75.32 101.12 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 121.597 0.713 . . . . 74.03 111.325 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 65.74 91.25 0.08 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 113.754 -1.566 . . . . 74.51 109.832 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -84.11 176.04 9.08 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.614 -1.176 . . . . 73.51 111.053 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 64.04 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 74.15 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 75.53 110.459 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 72.33 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.417 ' O ' ' HB1' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 75.42 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.474 HD23 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.44 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 72.53 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.513 ' CG2' ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 64.25 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 73.2 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.676 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 14.0 m120 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 73.25 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 74.41 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.459 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.498 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 74.53 112.397 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 74.51 108.039 173.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 75.22 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 74.25 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 74.32 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.54 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 62.5 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 72.2 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 75.54 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.521 HD12 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 73.23 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 75.43 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 73.51 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 64.42 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 63.04 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 75.41 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 74.02 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.43 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.41 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.479 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 60.42 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 72.44 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 74.31 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 74.4 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 64.04 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 73.23 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.407 ' N ' HD21 ' A' ' 98' ' ' ASN . 0.8 OUTLIER -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 62.44 111.26 -177.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.676 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 75.52 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 74.45 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 62.51 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 54.2 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.581 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 75.54 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.469 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 65.05 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 72.23 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 72.31 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 74.42 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.418 HG21 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 75.34 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 70.33 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 75.45 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 75.44 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.415 HD21 HG23 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.445 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 75.11 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.45 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 73.41 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.46 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 75.02 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.65 ' O ' HG13 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 73.22 107.694 171.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 72.41 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.42 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 65.33 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 73.32 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 75.03 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 73.33 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 72.41 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 74.24 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.449 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.518 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 73.13 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 65.55 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . 0.41 ' HB2' HD11 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 74.32 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 74.23 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 75.03 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 73.43 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.33 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 75.52 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.405 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 72.44 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 75.2 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 72.34 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.479 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 75.22 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . 0.449 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 74.41 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 73.23 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 72.23 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.43 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . 0.415 HG23 HD21 ' A' ' 119' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 53.42 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 74.22 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 74.24 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 72.34 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 73.12 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 72.22 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 71.5 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 74.22 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 65.14 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 65.43 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -64.24 -42.61 96.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 74.35 109.351 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.51 -42.89 91.54 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 108.886 -0.783 . . . . 74.25 108.886 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.5 86.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.022 0.439 . . . . 75.0 110.68 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 25.5 ttt -62.41 -45.28 93.83 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.627 -0.715 . . . . 74.54 109.774 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 66.1 mtt -67.12 -39.35 86.62 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.569 -0.742 . . . . 75.44 110.74 178.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.7 -27.77 64.24 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.64 0.607 . . . . 71.43 112.64 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -36.83 66.39 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.033 -1.099 . . . . 75.55 108.033 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -53.92 7.2 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.298 -1.001 . . . . 73.4 108.298 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -148.93 -95.45 0.15 Allowed Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.562 -1.015 . . . . 73.4 110.562 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 38.3 pt -144.05 166.76 12.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 108.469 -0.937 . . . . 74.33 108.469 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.4 t -100.75 88.6 3.63 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 106.798 -1.556 . . . . 72.21 106.798 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -103.41 129.02 9.72 Favored Glycine 0 N--CA 1.432 -1.58 0 C-N-CA 120.495 -0.859 . . . . 61.52 112.295 -176.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -116.91 -178.28 3.4 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.457 -0.571 . . . . 71.45 109.457 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -91.42 -50.74 5.64 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 110.161 -0.311 . . . . 71.4 110.161 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 72.08 35.58 60.95 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.98 -0.554 . . . . 73.32 112.677 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -80.44 -51.93 8.25 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.79 -0.241 . . . . 71.12 110.421 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? 77.63 136.63 0.06 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 124.938 1.399 . . . . 72.2 109.596 -174.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 125.619 1.567 . . . . 72.13 109.707 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.5 m . . . . . 0 C--O 1.244 0.779 0 CA-C-O 120.625 0.25 . . . . 70.03 111.448 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.4 p -163.3 117.51 1.62 Allowed 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.344 0.658 . . . . 74.2 109.315 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -126.17 176.01 17.58 Favored Glycine 0 N--CA 1.423 -2.2 0 C-N-CA 120.068 -1.063 . . . . 74.24 112.785 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mp -82.43 150.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 N-CA-C 108.318 -0.993 . . . . 65.41 108.318 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 7.2 mp0 -52.85 141.04 22.65 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.284 1.033 . . . . 75.5 110.179 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.21 126.42 8.25 Favored Glycine 0 N--CA 1.426 -2.031 0 N-CA-C 107.994 -2.043 . . . . 54.31 107.994 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 p -65.67 116.45 6.9 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 117.358 0.579 . . . . 72.21 111.009 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.2 m -81.97 77.83 8.74 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-O 121.899 0.857 . . . . 75.44 109.367 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -137.19 132.71 34.28 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-N 114.991 -1.004 . . . . 73.12 108.661 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.483 ' OD1' ' HG3' ' A' ' 12' ' ' LYS . 24.2 t0 -139.59 124.13 18.25 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.992 -0.744 . . . . 71.24 108.992 175.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -89.33 -13.17 38.52 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.414 -0.812 . . . . 73.3 110.993 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' HG3' ' OD1' ' A' ' 10' ' ' ASP . 50.0 mttp -55.34 119.74 6.04 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.009 0.433 . . . . 73.2 111.544 -176.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -124.46 128.3 48.8 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.156 -0.683 . . . . 74.34 109.156 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -109.42 -34.3 6.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 120.263 -0.575 . . . . 74.54 111.425 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.8 m 61.54 78.57 0.28 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.966 0.791 . . . . 71.32 111.538 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.4 t -73.05 101.84 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.205 -0.907 . . . . 74.44 110.664 -176.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -91.92 143.36 11.48 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 CA-C-N 115.031 -0.986 . . . . 75.11 109.489 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.268 0.0 OUTLIER -89.22 141.66 28.33 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.957 0.725 . . . . 75.53 112.957 178.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.3 -162.17 36.52 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 114.871 -1.059 . . . . 63.13 113.31 -175.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 72.9 86.36 0.11 Allowed 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.368 1.467 . . . . 70.54 109.944 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.2 p -115.52 111.4 20.67 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.758 -1.11 . . . . 73.11 110.609 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.6 m -145.57 83.08 1.65 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.0 -0.741 . . . . 70.33 109.0 176.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 19.3 t -96.72 57.98 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.735 0.779 . . . . 73.35 110.149 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 23' ' ' VAL . 25.9 tt0 165.32 161.05 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 104.698 -2.334 . . . . 75.41 104.698 176.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB1' ' NE2' ' A' ' 30' ' ' GLN . . . -146.02 152.72 39.81 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 176.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.51 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 73.34 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.507 HD13 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.34 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.51 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 73.53 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 74.52 108.977 176.177 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.463 HD12 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 73.31 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 74.22 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 75.23 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 73.34 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.731 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 51.34 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 74.53 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 75.54 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 72.25 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.521 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 75.35 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 72.24 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.649 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 70.11 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 72.14 110.276 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 65.44 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.423 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . 0.262 0.9 OUTLIER 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 71.34 113.274 -175.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 71.13 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.52 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 75.4 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 71.52 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 51.45 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.456 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 74.02 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 72.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.731 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 64.54 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.24 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.463 ' HE2' HD12 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 73.11 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 74.31 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 64.1 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 74.44 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 75.43 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 73.54 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.402 ' O ' HD12 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 73.35 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.649 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 75.02 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 75.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 75.15 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 74.4 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.451 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 62.02 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 72.43 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.47 ' O ' HG21 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 71.25 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.54 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 62.22 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 72.11 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 75.01 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 73.44 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.524 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 72.02 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.465 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 74.0 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 73.23 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.465 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 75.31 110.862 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.662 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 74.12 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.33 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 71.32 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 74.24 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.46 ' CD1' HG23 ' A' ' 142' ' ' ILE 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 74.33 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.411 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 65.45 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 60.33 109.46 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 63.32 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 73.55 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 75.52 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 63.25 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 74.34 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.46 HG23 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 71.12 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 73.03 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.51 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.415 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.451 ' O ' HG21 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 73.35 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.662 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 151' ' ' ASN . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 71.22 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.507 ' ND1' HD13 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 61.41 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.532 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.532 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 75.24 110.084 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 75.04 111.278 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 75.43 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.41 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 74.4 111.735 -177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 54.41 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.48 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.54 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 75.4 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 75.14 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . 0.55 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 72.45 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.42 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.55 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 74.24 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.423 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 73.34 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 75.22 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 73.02 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' A' ' 205' ' ' GLU . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.409 177.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 62.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 201' ' ' LYS . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 70.23 110.434 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -70.23 -37.3 74.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 75.15 111.172 -177.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.73 -42.62 90.84 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.683 -0.488 . . . . 73.22 109.683 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -69.42 -35.36 75.65 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 116.184 -0.462 . . . . 60.44 110.338 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.1 ttt -65.43 -44.92 85.83 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.021 -0.536 . . . . 65.14 109.962 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 27.0 ttt -60.75 -43.32 98.09 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.967 -0.561 . . . . 75.22 110.044 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.65 84.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.793 -0.64 . . . . 73.11 111.152 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -74.4 -41.67 60.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.383 -0.371 . . . . 74.42 111.606 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . 0.558 ' HA ' HE21 ' A' ' 213' ' ' GLN . 0.0 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.849 -0.34 . . . . 74.14 110.412 179.204 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -179.98 103.19 0.17 Allowed Glycine 0 N--CA 1.422 -2.287 0 C-N-CA 120.068 -1.063 . . . . 73.21 111.365 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 7.0 tp -78.69 103.43 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.304 0 N-CA-C 108.27 -1.011 . . . . 71.44 108.27 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.9 t -147.97 164.23 34.4 Favored 'General case' 0 N--CA 1.42 -1.956 0 N-CA-C 107.95 -1.13 . . . . 73.32 107.95 -174.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 111.4 112.41 3.3 Favored Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 111.103 -0.799 . . . . 74.43 111.103 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -85.34 14.33 5.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.085 0.469 . . . . 71.35 111.401 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -93.68 162.47 13.93 Favored 'General case' 0 C--O 1.25 1.094 0 CA-C-O 121.441 0.639 . . . . 74.44 110.644 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -161.24 -175.17 31.97 Favored Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 107.429 -2.268 . . . . 71.24 107.429 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -114.31 95.8 5.46 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 122.014 0.911 . . . . 75.04 113.358 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -102.03 126.05 48.87 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 113.734 -1.575 . . . . 74.23 106.965 174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 . . . . . 0 C--O 1.244 0.811 0 O-C-N 124.304 1.003 . . . . 73.11 109.881 -178.538 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 120.801 0.334 . . . . 75.21 110.311 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 m -152.0 176.76 11.17 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.302 -0.999 . . . . 72.22 108.302 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 114.67 178.65 18.89 Favored Glycine 0 N--CA 1.437 -1.277 0 C-N-CA 120.782 -0.723 . . . . 71.03 111.455 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tt -136.56 131.87 48.13 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 CA-C-O 121.196 0.522 . . . . 65.14 110.865 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -123.68 74.65 1.28 Allowed 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 107.97 -1.122 . . . . 72.4 107.97 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.21 32.28 5.53 Favored Glycine 0 C--N 1.309 -0.965 0 CA-C-N 115.783 -0.644 . . . . 73.25 112.804 -175.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 p -94.53 105.97 17.94 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 121.127 0.489 . . . . 74.14 110.427 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.4 t -144.02 88.6 1.97 Allowed 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 107.528 -1.286 . . . . 72.34 107.528 175.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -135.15 131.15 36.46 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.281 -0.872 . . . . 73.41 110.376 -172.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -94.29 161.16 14.36 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.665 -0.698 . . . . 64.5 109.716 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.91 -59.67 2.6 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.827 -0.805 . . . . 74.04 108.827 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.6 mttp 179.5 170.05 1.06 Allowed 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 127.868 2.467 . . . . 75.53 104.413 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -110.76 81.12 1.38 Allowed 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 107.287 -1.375 . . . . 71.41 107.287 167.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.02 -41.87 97.3 Favored 'General case' 0 CA--C 1.481 -1.706 0 CA-C-N 114.292 -1.322 . . . . 74.35 111.208 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 55.86 87.68 0.05 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 124.905 1.378 . . . . 65.43 110.907 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -79.87 91.3 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.774 -0.825 . . . . 74.35 108.774 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.25 121.01 41.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.723 0.773 . . . . 62.22 111.403 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -115.01 105.22 12.71 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.31 -0.996 . . . . 73.21 108.31 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.56 104.28 1.34 Allowed Glycine 0 N--CA 1.439 -1.15 0 O-C-N 123.514 0.509 . . . . 72.44 112.199 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.44 115.7 21.58 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.422 -0.585 . . . . 73.44 109.422 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.9 m -156.28 129.7 8.2 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.276 -1.379 . . . . 64.54 107.276 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.8 m -77.88 81.42 4.29 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.256 0.55 . . . . 75.45 111.708 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.41 HG12 ' OE2' ' A' ' 24' ' ' GLU . 13.1 t -102.31 121.24 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 106.097 -1.816 . . . . 73.32 106.097 177.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' HG12 ' A' ' 23' ' ' VAL . 1.7 mp0 76.16 111.58 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.805 1.242 . . . . 53.14 110.267 -171.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.62 175.99 6.62 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.9 -0.591 . . . . 62.32 109.876 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' ILE . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.403 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 73.52 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 55.32 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 64.42 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.45 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 73.0 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 60.1 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 73.43 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 73.02 108.562 173.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 74.21 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 74.25 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 74.51 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.54 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 75.24 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 73.15 109.882 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.3 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.424 ' HA ' HG23 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 64.33 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 73.1 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 74.24 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.444 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 72.12 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.512 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 74.21 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.532 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.3 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.512 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 70.03 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 73.44 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 61.43 111.464 178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.444 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 71.32 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 74.15 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 74.51 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 72.41 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 73.54 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 73.43 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 72.22 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 74.13 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 73.42 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 75.55 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 72.5 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 74.35 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.4 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 63.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.22 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 75.02 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.507 ' HG3' HG23 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 74.31 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.509 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.455 ' O ' HG21 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.23 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.695 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 74.3 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 74.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 72.44 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 72.53 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 75.33 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 73.12 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . 0.446 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.446 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 75.32 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 72.44 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.475 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 74.12 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.419 HG21 HD13 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 73.34 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.61 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 60.41 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 74.44 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.401 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 74.41 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 75.22 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 64.25 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 74.03 109.573 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.632 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 74.3 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 64.35 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.475 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 74.03 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 72.44 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 61.51 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 73.15 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 70.23 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.425 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 73.22 107.905 -178.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 71.23 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 74.32 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 75.05 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 73.3 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 74.23 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.435 ' H ' HG21 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 73.21 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . 0.419 HD13 HG21 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 73.54 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.54 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 71.33 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 74.45 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 74.53 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 73.45 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 63.42 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 72.2 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 70.41 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' MET . . . . . 0.434 ' HA ' ' HE3' ' A' ' 185' ' ' MET . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 65.44 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 73.12 110.038 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 64.43 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 73.22 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 72.41 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.695 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 74.11 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 74.51 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 74.2 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 74.21 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 75.05 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 72.52 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 74.42 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 75.54 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.73 -45.19 62.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.33 -39.67 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.393 -0.367 . . . . 70.53 111.407 -178.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -68.63 -37.45 79.73 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.355 -0.384 . . . . 73.42 111.299 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.1 ttt -72.98 -41.53 64.26 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.158 -0.473 . . . . 71.0 110.662 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.418 ' O ' ' HG3' ' A' ' 213' ' ' GLN . 3.7 ppp? -73.66 -30.89 63.18 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 120.306 -0.558 . . . . 73.14 111.458 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . 0.485 ' HA ' ' O ' ' A' ' 215' ' ' ILE . . . -74.06 -33.84 63.84 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-O 121.116 0.484 . . . . 75.32 109.704 177.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -66.83 -41.05 88.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.784 -0.644 . . . . 74.14 110.977 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 210' ' ' MET . 5.4 pp0? -67.92 -14.44 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.466 0.543 . . . . 75.05 112.466 -177.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 165.52 -88.09 0.1 Allowed Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 119.42 -1.371 . . . . 75.04 113.45 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 211' ' ' ALA . 42.1 pt -90.53 159.38 2.83 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 112.377 0.51 . . . . 71.02 112.377 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 8.2 p -98.57 134.94 40.82 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.563 -1.273 . . . . 74.44 107.563 174.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -133.67 103.43 0.5 Allowed Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 119.616 -1.278 . . . . 73.24 114.138 -173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -150.37 99.39 2.77 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.505 -1.665 . . . . 63.13 106.505 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -79.93 129.34 34.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.079 0.77 . . . . 72.34 113.079 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -88.23 124.32 7.13 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 114.716 -1.129 . . . . 54.33 110.827 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -135.59 168.94 18.32 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.264 -1.013 . . . . 72.44 108.264 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . 0.438 ' HE2' ' OD1' ' A' ' 223' ' ' ASP . 18.1 ptmt -95.07 -31.93 13.35 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.827 0.346 . . . . 74.23 110.107 176.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . 0.438 ' OD1' ' HE2' ' A' ' 222' ' ' LYS . 6.9 p-10 . . . . . 0 CA--C 1.502 -0.872 0 N-CA-C 108.335 -0.987 . . . . 63.34 108.335 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.798 -0.816 . . . . 73.35 108.798 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.8 m -77.99 151.8 33.41 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 116.278 -0.419 . . . . 71.22 109.985 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.33 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.998 -0.841 . . . . 73.23 110.998 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -104.49 104.53 16.98 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.196 -1.038 . . . . 75.22 108.196 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -99.97 115.76 30.45 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 115.904 -0.589 . . . . 65.11 109.909 -178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -140.72 54.51 0.64 Allowed Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 110.386 -1.085 . . . . 71.11 110.386 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 p -93.74 86.91 5.27 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.849 0.833 . . . . 72.42 110.525 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -97.17 102.57 14.38 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.054 -1.091 . . . . 72.1 108.054 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -85.78 77.98 9.64 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.502 1.144 . . . . 63.51 111.898 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -137.61 99.99 4.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 104.931 -2.248 . . . . 73.14 104.931 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -46.99 -52.67 14.17 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.411 1.634 . . . . 73.2 115.411 -170.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.7 mptt 70.28 80.7 0.17 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.506 0.67 . . . . 73.53 111.001 -169.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -138.28 122.77 18.43 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.381 -0.97 . . . . 73.33 108.381 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.62 -57.34 3.94 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.947 -0.57 . . . . 74.55 111.328 -173.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m 38.16 68.53 0.31 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.465 1.506 . . . . 73.52 114.67 177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.3 t -100.52 114.76 40.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 108.846 -0.798 . . . . 74.33 108.846 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -90.5 145.73 7.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 109.409 -0.589 . . . . 74.05 109.409 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -145.0 148.3 33.59 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.637 -0.875 . . . . 75.41 108.637 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.9 56.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.927 0 N-CA-C 109.457 -1.457 . . . . 70.52 109.457 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 123.35 27.35 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.134 -0.533 . . . . 73.34 112.008 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.0 t -173.49 132.39 0.47 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.19 -1.041 . . . . 71.34 108.19 176.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.6 m -85.29 107.22 17.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 109.25 -0.648 . . . . 75.01 109.25 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.74 99.66 2.21 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-O 120.99 0.424 . . . . 75.14 110.811 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 67.7 160.26 0.16 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.349 1.459 . . . . 62.22 113.1 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -98.93 173.84 6.65 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 114.93 -1.032 . . . . 74.24 111.643 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 75.43 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 65.32 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.46 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 74.12 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 63.14 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 74.22 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 73.43 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 73.41 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 74.35 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 74.41 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 74.34 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 72.21 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.49 HG23 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.32 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.34 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 74.4 113.849 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.697 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 72.24 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 14.8 m120 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 70.34 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.445 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 75.52 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 72.03 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 73.32 112.482 -173.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 61.5 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 70.3 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 72.14 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 74.42 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 73.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 73.21 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.498 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 72.44 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 73.42 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.409 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.498 ' HZ2' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 74.33 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 73.25 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.451 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 63.54 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 61.21 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 73.54 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 62.11 110.449 -176.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 71.34 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 63.55 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 74.51 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 71.23 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.697 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 73.45 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 61.44 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 63.12 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 73.44 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.59 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 73.25 111.631 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 72.43 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 72.33 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 71.11 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.439 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 73.21 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 73.32 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.498 ' CD ' ' HZ2' ' A' ' 82' ' ' LYS 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.615 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 72.53 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 64.3 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 63.44 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 74.41 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 71.03 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.439 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 73.14 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 72.43 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.45 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 73.34 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 70.54 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 73.43 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 70.32 111.495 -176.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 71.35 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 71.23 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 74.33 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.615 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 150' ' ' THR . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 74.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 63.11 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.31 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 70.03 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.46 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 73.4 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.418 ' H ' HD22 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.431 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 74.14 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.22 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.24 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 75.54 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.41 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 72.44 110.906 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 73.35 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 64.33 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.41 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 73.04 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 73.14 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.437 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 73.34 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 74.44 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 73.55 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 74.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 65.52 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 62.44 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 71.22 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . 0.455 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 72.42 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 74.32 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 72.32 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 62.23 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 70.34 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.91 -42.83 84.77 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 74.0 110.104 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 54.8 tp -69.76 -39.21 76.83 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.835 -0.431 . . . . 73.31 109.835 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.31 -43.47 94.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.447 0.641 . . . . 64.34 109.994 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 44.6 ttm -63.69 -41.46 98.13 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.372 -0.831 . . . . 70.53 110.015 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 43.5 ttm -64.9 -44.19 90.39 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.194 -0.912 . . . . 73.31 109.987 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -65.62 -40.98 93.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.614 -0.721 . . . . 74.31 110.654 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.21 -24.54 64.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.644 0.735 . . . . 73.25 110.494 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -88.81 -8.06 55.04 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 115.409 -0.814 . . . . 75.25 110.084 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 74.93 33.76 54.39 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 116.009 -0.541 . . . . 74.42 111.871 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . 0.498 ' O ' ' HG2' ' A' ' 210' ' ' MET . 49.7 mm -120.86 151.89 23.91 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 107.353 -1.351 . . . . 64.4 107.353 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.3 m -152.56 122.95 7.21 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.898 -0.408 . . . . 74.22 109.898 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 125.86 88.24 0.7 Allowed Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 119.741 -1.219 . . . . 73.04 114.597 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -129.92 91.66 3.17 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.497 -1.297 . . . . 75.24 107.497 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -79.49 129.92 34.92 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.586 0.708 . . . . 74.34 112.424 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -162.23 176.12 38.64 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 105.998 -2.841 . . . . 70.34 105.998 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -110.51 93.13 4.33 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 119.323 1.562 . . . . 74.5 109.982 177.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -113.33 7.41 17.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.321 -1.309 . . . . 73.34 108.278 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 105.767 -1.938 . . . . 74.03 105.767 -179.091 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.447 -0.605 0 N-CA-C 110.36 -0.237 . . . . 74.43 110.36 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 m 63.74 -174.5 0.16 Allowed 'General case' 0 C--O 1.249 1.052 0 C-N-CA 123.889 0.876 . . . . 71.15 112.878 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.8 176.49 48.05 Favored Glycine 0 N--CA 1.425 -2.044 0 N-CA-C 107.227 -2.349 . . . . 73.55 107.227 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.79 90.71 2.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 CA-C-N 118.147 0.973 . . . . 65.0 110.529 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -98.3 85.67 3.48 Favored 'General case' 0 N--CA 1.417 -2.113 0 N-CA-C 108.381 -0.97 . . . . 74.43 108.381 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.43 28.67 10.4 Favored Glycine 0 C--N 1.309 -0.961 0 N-CA-C 111.119 -0.792 . . . . 63.35 111.119 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 p -95.59 118.73 32.83 Favored 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 123.274 0.63 . . . . 70.44 110.003 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.6 t -156.19 127.62 7.16 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.181 0.515 . . . . 74.51 110.348 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -157.89 96.66 1.5 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.035 -1.469 . . . . 71.3 107.035 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.06 145.68 41.22 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.645 0.609 . . . . 75.55 112.645 -177.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -60.7 -29.38 69.3 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.605 1.162 . . . . 70.43 111.842 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 61.16 67.67 0.78 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.085 0.954 . . . . 74.34 109.754 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -89.16 92.03 9.03 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.935 0.874 . . . . 74.02 112.309 -176.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.5 -31.04 24.7 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.54 -0.911 . . . . 73.14 108.54 175.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.9 m 56.75 98.76 0.02 OUTLIER 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.206 1.403 . . . . 73.12 113.852 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.17 98.64 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.956 0 CA-C-O 122.378 1.085 . . . . 71.41 110.959 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.7 p -83.55 110.9 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 114.552 -1.204 . . . . 64.4 110.608 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.88 104.85 7.84 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.302 -0.999 . . . . 74.55 108.302 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.35 91.2 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 CA-C-N 115.733 -0.667 . . . . 74.21 112.482 -177.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.72 119.05 9.56 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.19 -1.041 . . . . 75.33 108.19 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -139.91 111.81 7.46 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 120.66 -0.416 . . . . 71.02 109.931 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.9 m -88.76 111.23 21.75 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 108.366 -0.975 . . . . 70.1 108.366 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.2 m -81.33 99.94 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 CA-C-O 121.691 0.758 . . . . 72.43 109.861 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 69.82 169.01 0.3 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 113.925 -1.489 . . . . 75.55 110.731 -173.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.79 178.31 6.08 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 115.058 -0.974 . . . . 65.54 108.71 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 65.1 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 73.05 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.13 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.408 HG21 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 75.34 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.459 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 53.11 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 72.33 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 75.0 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 65.55 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 72.24 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 75.52 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.464 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.51 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.488 HG23 ' CZ2' ' A' ' 50' ' ' TRP . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 75.55 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 64.31 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 74.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.531 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.43 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 73.14 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 75.14 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 74.22 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 0.8 OUTLIER 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 75.1 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 63.22 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 61.0 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 75.43 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.568 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 74.42 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 72.53 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 73.3 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.464 ' HG2' ' OH ' ' A' ' 38' ' ' TYR . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 74.52 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.417 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 74.41 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CZ ' HG21 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.55 ' O ' HG21 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 73.44 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.459 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 74.53 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.35 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 72.23 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.45 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.561 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 73.41 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 72.25 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.531 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 73.13 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 75.43 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 63.52 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 70.33 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 75.53 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.443 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 73.15 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.568 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 71.31 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 75.01 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 75.41 110.045 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 75.15 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.32 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 74.31 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 74.25 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.409 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 75.25 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 75.41 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 73.21 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.447 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 75.23 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.475 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 72.34 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.475 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 74.51 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.516 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 55.51 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 73.25 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 63.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.516 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 74.2 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 70.12 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.41 108.169 -177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.503 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.545 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 74.53 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 74.35 111.362 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . 0.416 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.484 ' O ' HG21 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 74.54 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.439 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 74.44 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 75.51 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.604 ' ND1' HD13 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 73.42 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 74.24 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 73.11 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.561 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . 0.545 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.457 ' H ' HG21 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 65.3 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 75.21 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 75.44 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 62.53 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.447 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 71.35 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 74.42 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . 0.425 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 73.22 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.479 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . 0.547 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 74.45 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 75.42 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 72.44 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.51 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 75.42 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . 0.46 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 73.52 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' THR . . . . . 0.421 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 75.52 108.762 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -72.44 -38.94 68.17 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 74.32 111.754 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.55 -33.96 41.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 119.682 -0.807 . . . . 74.4 110.476 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -66.17 -44.66 83.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.113 -0.494 . . . . 72.14 110.306 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' MET . . . . . 0.513 ' O ' ' HG2' ' A' ' 213' ' ' GLN . 53.0 ttm -63.71 -40.66 97.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.52 -0.472 . . . . 72.35 110.07 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.2 ttt -65.58 -38.84 90.67 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-N 116.105 -0.498 . . . . 73.11 110.873 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.94 -34.69 77.07 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.833 0.349 . . . . 72.24 111.163 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 43.9 mt-10 -76.7 -50.16 14.33 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.732 0.641 . . . . 74.44 112.732 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 209' ' ' MET . 19.6 pt20 -104.25 17.56 23.88 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.41 0.624 . . . . 74.15 112.611 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -146.28 -123.44 1.51 Allowed Glycine 0 N--CA 1.428 -1.874 0 N-CA-C 110.319 -1.112 . . . . 73.21 110.319 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 40.4 pt -119.94 158.33 21.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-O 120.934 0.397 . . . . 75.12 110.309 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.5 m -100.21 123.62 44.67 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 108.395 -0.965 . . . . 72.14 108.395 177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -80.99 97.77 1.79 Allowed Glycine 0 N--CA 1.439 -1.126 0 N-CA-C 111.235 -0.746 . . . . 73.15 111.235 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -132.83 98.35 4.29 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 120.704 0.288 . . . . 62.53 110.819 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 178.19 144.12 0.11 Allowed 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 125.225 1.41 . . . . 74.01 107.984 174.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -142.75 -142.99 4.1 Favored Glycine 0 N--CA 1.412 -2.962 0 N-CA-C 110.891 -0.884 . . . . 74.4 110.891 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.95 -60.67 0.23 Allowed 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 108.889 -0.782 . . . . 75.05 108.889 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.0 tttp 72.35 128.31 0.03 OUTLIER 'General case' 0 C--O 1.247 0.972 0 O-C-N 124.508 1.13 . . . . 73.34 111.583 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--N 1.29 -2.008 0 N-CA-C 105.077 -2.194 . . . . 72.3 105.077 173.558 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.727 0 CA-C-O 120.427 0.156 . . . . 70.42 111.079 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -160.85 151.58 18.4 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.18 -1.044 . . . . 72.5 108.18 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.03 -171.47 35.03 Favored Glycine 0 N--CA 1.429 -1.771 0 N-CA-C 109.82 -1.312 . . . . 73.53 109.82 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 67.8 mt -79.4 124.8 38.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 108.212 -1.033 . . . . 62.42 108.212 178.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.33 101.58 10.66 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.769 0.795 . . . . 72.24 110.055 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.42 17.04 59.69 Favored Glycine 0 C--N 1.314 -0.652 0 CA-C-N 115.293 -0.867 . . . . 61.34 111.609 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.9 p -83.79 102.87 12.63 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 123.233 0.613 . . . . 75.33 109.54 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.8 t -144.86 25.21 1.46 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.893 0.854 . . . . 74.31 109.71 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -78.45 132.51 37.32 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.051 -0.977 . . . . 73.42 109.155 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.53 135.07 48.27 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.991 -0.55 . . . . 74.41 110.224 -177.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.54 -33.26 42.04 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.899 -0.591 . . . . 74.25 111.641 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 2.2 mptp? -67.34 144.7 55.71 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 72.03 113.152 -166.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -96.76 174.11 6.97 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.086 -0.961 . . . . 73.31 109.62 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -73.05 -56.44 5.12 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.89 -0.595 . . . . 72.44 111.307 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.5 m -145.58 108.66 4.57 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.379 0.609 . . . . 73.43 110.307 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.5 t -84.45 86.69 2.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.62 -0.718 . . . . 72.43 109.34 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.0 t -126.55 97.42 4.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 N-CA-C 107.784 -1.191 . . . . 71.15 107.784 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -104.83 96.65 6.7 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 109.643 -0.503 . . . . 64.54 109.643 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.75 91.57 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.539 0 C-N-CA 120.188 -1.006 . . . . 71.05 111.697 -178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.36 169.26 9.47 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.835 -0.802 . . . . 64.15 108.835 177.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 m -98.21 106.02 18.25 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 109.489 -0.559 . . . . 74.22 109.489 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.4 p -84.52 99.04 10.46 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.246 0.546 . . . . 64.5 110.863 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.2 t -86.95 137.45 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 108.103 -1.073 . . . . 73.42 108.103 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 69.36 101.54 0.06 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.733 1.213 . . . . 73.33 110.477 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.88 176.28 7.98 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.162 -0.926 . . . . 63.34 110.903 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 74.44 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 71.42 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 73.05 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.566 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.44 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 72.13 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 73.24 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 71.35 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 73.15 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 73.42 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 74.15 110.372 -179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 73.11 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 72.23 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 62.13 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 75.04 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.25 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.494 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 72.23 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 72.33 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.535 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 74.3 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.424 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.458 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 75.4 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 74.32 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.408 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.562 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 74.31 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 74.24 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 65.35 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.458 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.53 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.404 ' O ' HD12 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 72.22 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 71.24 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 74.54 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.43 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 75.32 109.087 169.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.686 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 63.13 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 75.03 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 75.22 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 73.43 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.466 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 74.44 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 75.33 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.483 ' O ' HD11 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 75.23 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 63.14 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 64.24 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 75.32 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.466 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 75.4 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 64.31 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 61.25 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 71.01 106.881 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 73.41 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.34 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.704 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 73.25 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.448 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.46 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 61.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.51 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.44 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 75.44 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.479 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 64.21 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.5 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.419 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 64.33 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 72.34 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.571 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 74.43 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 74.41 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 72.1 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.571 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 74.23 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.22 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 73.4 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.24 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 65.02 109.435 -172.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 73.1 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 72.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.432 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 72.32 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 72.45 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 74.45 108.042 173.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 72.12 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 74.54 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . 0.519 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 75.51 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 71.52 110.322 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 62.33 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 75.01 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.44 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.447 ' O ' HG21 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 75.04 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 74.4 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.414 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.44 ' HD1' ' O ' ' A' ' 150' ' ' THR . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 75.13 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 72.1 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 71.11 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.577 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 74.52 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . 0.577 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 73.3 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . 0.519 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 71.34 107.918 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . 0.448 ' O ' HG21 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 75.43 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.577 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 71.44 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 71.4 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 64.12 111.222 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 75.12 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.442 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 72.3 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . 0.414 ' N ' HD11 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.44 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 71.44 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.479 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 74.25 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . 0.477 ' HA ' HG21 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 75.32 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.408 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . 0.477 HG21 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 75.55 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 72.12 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 64.04 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 74.25 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -67.12 -41.43 86.19 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.58 -28.81 67.27 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.892 0.377 . . . . 75.01 110.515 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . 0.47 ' O ' ' HG2' ' A' ' 212' ' ' GLU . . . -70.35 -42.65 71.56 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.907 -0.775 . . . . 51.33 108.907 175.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 53.6 ttm -65.73 -33.75 76.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.433 0.635 . . . . 70.55 110.343 176.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' MET . . . . . 0.413 ' HE1' ' O ' ' A' ' 218' ' ' ALA . 85.7 mtp -68.8 -29.53 67.91 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.669 176.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -75.75 -24.56 56.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.457 0.646 . . . . 61.11 110.014 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 208' ' ' ALA . 16.9 mm-40 -70.57 -37.98 74.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.393 -0.965 . . . . 62.1 108.393 173.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.26 -48.68 69.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.109 -0.95 . . . . 73.15 108.553 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 168.54 -91.01 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.384 0 N-CA-C 108.766 -1.734 . . . . 75.42 108.766 178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 20.5 pt -140.39 -39.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 108.155 -1.054 . . . . 75.31 108.155 171.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 22.8 t 69.15 155.11 0.12 Allowed 'General case' 0 C--O 1.25 1.103 0 C-N-CA 124.891 1.276 . . . . 73.32 111.948 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -115.45 67.46 0.28 Allowed Glycine 0 N--CA 1.422 -2.279 0 N-CA-C 110.092 -1.203 . . . . 74.43 110.092 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . 0.413 ' O ' ' HE1' ' A' ' 210' ' ' MET . . . -148.52 108.97 4.15 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.263 -0.643 . . . . 72.23 109.263 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.94 150.6 49.27 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.966 -0.753 . . . . 73.43 108.966 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -112.34 84.19 0.35 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.408 -0.901 . . . . 74.55 112.692 -177.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -149.59 145.86 27.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.468 -0.938 . . . . 75.24 108.468 176.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . 0.448 ' HG2' ' OD1' ' A' ' 223' ' ' ASP . 57.6 tttm -122.04 -73.66 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 120.64 -0.424 . . . . 70.42 111.798 -176.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . 0.448 ' OD1' ' HG2' ' A' ' 222' ' ' LYS . 5.4 p-10 . . . . . 0 CA--C 1.481 -1.683 0 N-CA-C 103.753 -2.684 . . . . 73.24 103.753 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.434 -1.246 0 N-CA-C 108.791 -0.818 . . . . 75.33 108.791 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 t -92.68 120.54 33.19 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.676 -1.231 . . . . 72.32 107.676 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.41 -176.72 34.34 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.737 -0.744 . . . . 61.22 111.741 -176.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.4 pt -99.56 101.34 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-O 122.079 0.942 . . . . 74.33 110.619 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -121.63 137.87 54.57 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 114.731 -1.122 . . . . 73.22 108.381 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -149.1 66.68 0.38 Allowed Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.052 -0.819 . . . . 53.21 111.052 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.8 t -93.26 107.74 19.5 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.793 -0.817 . . . . 64.54 108.793 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.4 m -139.77 106.63 5.4 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 109.235 -0.654 . . . . 74.15 109.235 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -80.37 96.4 6.67 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.957 -0.565 . . . . 73.34 110.274 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.31 109.81 21.09 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 106.618 -1.623 . . . . 72.15 106.618 176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.79 -29.1 70.34 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 115.059 1.503 . . . . 71.23 115.059 -168.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mptt 61.64 75.59 0.4 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.034 0.445 . . . . 74.21 110.961 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.43 129.13 34.97 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.284 -1.376 . . . . 73.32 107.284 174.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -84.16 -56.87 3.43 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 109.36 -0.607 . . . . 74.22 109.36 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.8 m 46.16 84.37 0.03 OUTLIER 'General case' 0 C--O 1.241 0.626 0 N-CA-C 114.82 1.415 . . . . 73.44 114.82 177.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 91.8 t -86.2 99.96 8.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.797 -1.186 . . . . 74.11 107.797 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -78.05 97.77 2.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 122.062 0.934 . . . . 74.23 109.156 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -129.99 152.55 49.33 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 106.894 -1.521 . . . . 74.35 106.894 -176.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.1 70.71 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 118.999 -1.572 . . . . 65.11 113.194 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -158.12 136.68 11.14 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.229 -1.026 . . . . 73.24 108.229 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.3 p -99.16 157.66 16.22 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.412 -0.588 . . . . 72.1 109.412 178.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.441 ' C ' ' H ' ' A' ' 24' ' ' GLU . 17.7 m -74.48 99.56 3.6 Favored 'General case' 0 N--CA 1.428 -1.536 0 N-CA-C 108.114 -1.069 . . . . 51.53 108.114 175.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -91.15 22.33 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.342 1.068 . . . . 63.53 111.857 -174.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.441 ' H ' ' C ' ' A' ' 22' ' ' SER . 70.7 mm-40 -141.06 138.96 33.97 Favored 'General case' 0 C--N 1.255 -3.511 0 CA-C-N 112.309 -2.223 . . . . 75.42 107.814 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -100.0 171.62 7.72 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.647 -0.706 . . . . 73.44 109.447 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.44 110.228 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 73.21 111.518 -174.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 72.03 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 75.21 111.089 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.444 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 75.22 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.14 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 75.21 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 74.01 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 72.41 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 75.53 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 63.13 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.562 HG21 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 64.25 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 74.33 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.562 ' CZ2' HG21 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 75.34 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 75.32 107.688 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HA ' HG23 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.549 ' O ' HD12 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 53' ' ' ASP . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 75.32 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 75.25 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 64.21 113.788 -172.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.416 ' O ' HG23 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.33 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.45 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 72.24 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.54 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.34 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.24 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 71.22 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 60.14 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 71.15 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 74.22 112.699 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.432 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 74.41 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 75.23 110.288 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.436 ' O ' HD12 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 73.44 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.446 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 73.33 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 73.1 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.432 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 73.25 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 64.23 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 74.3 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 72.42 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.54 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 74.1 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 75.25 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 74.33 114.883 -175.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.443 ' C ' ' HB3' ' A' ' 223' ' ' ASP . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 55.3 112.019 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 73.54 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.487 ' O ' HG21 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.447 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 74.42 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 73.53 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 71.22 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 74.51 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.591 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 75.32 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 75.51 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.14 111.423 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 70.14 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 74.42 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 74.33 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.467 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.12 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.489 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.489 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 74.24 109.353 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 75.34 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.451 ' HA ' HG13 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 73.01 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.55 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 75.4 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' THR . . . . . 0.55 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.451 HG13 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 62.2 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 75.45 110.244 177.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 74.32 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . 0.478 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 73.32 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 71.11 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ASN . . . . . 0.441 ' O ' HG21 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.43 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' TRP . . . . . 0.467 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 74.5 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 62.4 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 53.1 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.41 111.42 -176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . 0.444 ' HB3' ' CG ' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 75.13 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.444 ' CG ' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ASN . . . . . 0.446 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 75.14 107.535 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 73.03 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 73.35 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 55.11 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 71.14 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.51 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ASN . . . . . 0.407 ' HA ' HG13 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 72.15 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 73.21 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 73.35 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' VAL . . . . . 0.407 HG13 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 75.3 108.466 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 75.24 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 72.44 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' ILE . . . . . 0.582 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 72.51 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' MET . . . . . 0.582 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 62.44 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 72.43 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 74.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.45 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' TRP . . . . . 0.452 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 74.43 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 74.5 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 72.34 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -61.93 -42.46 99.13 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.82 -31.28 64.69 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 119.666 -0.813 . . . . 73.44 111.749 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.68 49.59 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 121.194 -0.202 . . . . 72.21 110.787 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 60.0 ttp -65.36 -43.67 90.11 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.304 0.573 . . . . 73.11 109.463 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 48.0 ttm -69.15 -30.31 68.52 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.472 -0.785 . . . . 74.32 110.65 -178.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.87 -34.69 75.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.76 0.314 . . . . 62.53 110.656 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.04 -39.13 75.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.818 0.818 . . . . 73.11 108.81 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -63.05 -41.22 99.43 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.029 -1.441 . . . . 74.35 110.167 175.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 139.93 -92.3 0.19 Allowed Glycine 0 N--CA 1.424 -2.116 0 N-CA-C 107.111 -2.396 . . . . 74.21 107.111 -176.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 16.4 tt -173.13 120.75 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 CA-C-O 121.296 0.57 . . . . 65.02 110.582 172.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 47.2 t -91.82 -49.71 6.11 Favored 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.126 -1.435 . . . . 72.01 107.126 174.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 75.57 81.02 0.54 Allowed Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 111.146 -0.782 . . . . 74.54 111.146 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -117.16 146.66 43.05 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.679 -0.489 . . . . 63.53 109.679 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -148.97 122.44 9.1 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.297 -1.372 . . . . 74.1 107.297 -177.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -106.36 72.51 0.22 Allowed Glycine 0 C--N 1.302 -1.349 0 C-N-CA 120.147 -1.025 . . . . 44.33 112.433 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.8 tttp 69.75 -65.54 0.3 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.896 1.278 . . . . 74.24 110.873 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp 174.4 -63.73 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.958 -1.868 . . . . 74.11 105.958 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 223' ' ' ASP . . . . . 0.443 ' HB3' ' C ' ' A' ' 103' ' ' GLY . 11.7 m-20 . . . . . 0 C--N 1.301 -1.51 0 N-CA-C 107.361 -1.348 . . . . 62.11 107.361 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.451 0 N-CA-C 109.701 -0.481 . . . . 53.1 109.701 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.24 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.544 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 61.2 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 53.5 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.499 ' HB ' ' CZ ' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 60.14 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 64.43 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 53.34 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 54.4 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 50.1 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 74.44 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 73.25 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 54.01 111.997 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 65.34 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 62.11 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 52.32 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 72.21 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.552 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 50.32 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 64.04 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 61.1 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 71.03 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.587 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 61.12 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 34.11 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.666 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 61.24 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.24 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 72.51 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 54.43 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 HG21 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 63.2 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CZ ' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 64.24 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 72.11 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 71.21 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 64.03 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.423 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 61.44 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 72.14 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.478 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 71.1 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 70.04 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 53.12 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 63.22 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 39' ' ' SER . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 51.13 105.956 175.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.429 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 43.22 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 62.24 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 63.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 64.41 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 72.33 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 52.11 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 64.33 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.418 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 70.13 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.465 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 72.21 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.609 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 54.05 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 51.12 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 60.41 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.518 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 72.04 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 62.14 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.636 ' HD2' HG11 ' A' ' 180' ' ' VAL . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 44.32 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.489 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 71.33 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.52 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.458 ' N ' HD12 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 53.34 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.52 ' HE1' HG22 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 70.4 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.12 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 129' ' ' TRP . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 63.22 108.814 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 72.31 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 71.35 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 53.23 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.532 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 64.45 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 65.42 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 129' ' ' TRP . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.23 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 72.33 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.593 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.437 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.5 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.568 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 65.51 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.482 ' O ' HG22 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.489 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.42 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.482 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 51.31 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 73.2 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 70.22 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 65.53 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 63.23 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.423 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 55.43 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ASP . . . . . 0.593 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 54.53 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 62.32 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 64.13 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 53.52 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 65.31 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 70.33 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' VAL . . . . . 0.636 HG11 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 41.14 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 181' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 186' ' ' ILE . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 63.31 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 70.43 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 61.44 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 72.33 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 181' ' ' SER . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.45 HG21 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.03 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.609 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 71.1 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 73.24 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 64.15 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.3 108.795 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 64.23 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 74.51 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 45.22 110.412 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 . . . . . 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.889 0 CA-C-O 121.429 0.633 . . . . 75.14 111.327 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 64.12 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.2 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.456 ' HG3' HG13 ' A' ' 111' ' ' VAL . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 71.44 109.33 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.479 HD13 ' HE2' ' A' ' 82' ' ' LYS . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.531 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 70.24 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' HG11 ' A' ' 111' ' ' VAL . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 63.52 110.926 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 70.13 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 55.52 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 65.22 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 55.45 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 53.32 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 71.51 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.693 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 73.11 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 72.41 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.593 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 64.21 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.666 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 64.53 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.469 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 55.32 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.22 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 53.33 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 54.12 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 55.25 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 65.42 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 72.31 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 62.41 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 70.11 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 63.21 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 61.34 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.41 ' O ' HG23 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.04 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.412 HD12 HD21 ' A' ' 179' ' ' LEU . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.479 ' HE2' HD13 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 53.54 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 64.03 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 70.04 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 65.22 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 91' ' ' GLU . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 73.52 110.411 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 73.12 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 62.44 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 74.54 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 53.11 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 65.32 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 108' ' ' MET . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.515 ' O ' HG23 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 63.41 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 104' ' ' ASP . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 72.13 110.949 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.531 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 73.2 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.464 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 44.32 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 64.22 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 63.44 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 71.24 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.405 ' HG ' HG13 ' A' ' 176' ' ' VAL . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 64.01 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' HG11 ' A' ' 176' ' ' VAL . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 73.21 111.193 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 73.32 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.44 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 41.44 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 72.33 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 63.42 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 65.45 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.34 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 64.21 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 74.31 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 62.42 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 73.01 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.54 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 51.24 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 73.23 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 63.02 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.479 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.451 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 70.23 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 44.14 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 63.04 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.456 ' HA ' ' HG3' ' A' ' 28' ' ' LYS . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 60.41 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 72.2 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 61.53 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.506 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 74.54 110.938 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 51.01 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 74.34 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 72.43 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 55.22 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 45.31 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.55 HG11 ' HB2' ' A' ' 123' ' ' LYS . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.412 HD21 HD12 ' A' ' 81' ' ' LEU . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.13 113.144 -179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 61.33 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 185' ' ' MET . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.12 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' MET . . . . . 0.455 ' HB3' ' HB3' ' A' ' 182' ' ' HIS . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 50.2 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 71.21 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 64.2 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 60.2 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 199' ' ' TRP . . . . . 0.485 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 74.01 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 203' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 72.21 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 . . . . . 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.43 111.576 -176.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 121.086 0.469 . . . . 75.3 110.459 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 71.02 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 73.23 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 112' ' ' LEU . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 53.22 109.374 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 71.2 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.404 ' HB2' ' CD2' ' A' ' 79' ' ' HIS . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 62.13 111.817 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 52.4 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.548 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 64.53 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.529 HG21 ' HG3' ' A' ' 99' ' ' ARG . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.519 ' O ' HG22 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 53.41 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 61.25 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.3 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 71.41 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 60.25 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 41.23 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.411 ' O ' HG22 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.11 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 43.11 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 73.03 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 HG23 ' A' ' 67' ' ' ILE . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.22 110.767 179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 71.42 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 71.52 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 62.32 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 73.24 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.404 ' CD2' ' HB2' ' A' ' 39' ' ' SER . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 71.15 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 73.31 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 71.12 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 65.34 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 53.24 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.2 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 63.03 111.376 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.1 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 63.15 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 41.12 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 63.53 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 71.04 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.525 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.13 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 53.24 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 61.22 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.657 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 45.24 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 62.12 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 60.11 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.439 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 64.1 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 52.52 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 53.34 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.432 HD21 HD11 ' A' ' 172' ' ' LEU . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 54.02 108.749 172.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.476 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.463 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 65.05 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 132' ' ' VAL . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 70.53 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 72.44 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HA ' HG12 ' A' ' 141' ' ' VAL . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 70.22 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 62.3 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 61.2 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 74.31 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 143' ' ' GLN . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 62.42 108.727 172.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.501 ' HG2' HG23 ' A' ' 141' ' ' VAL . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASN . . . . . 0.419 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 71.3 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 63.44 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 63.24 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 73.33 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 64.51 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.554 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 54.34 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.486 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 62.44 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.481 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 73.0 109.525 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 72.2 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 122' ' ' LEU . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 72.1 110.814 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 72.52 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 173' ' ' ALA . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 71.44 109.468 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 73.23 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.11 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 70.01 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.498 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 62.15 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 74.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 65.45 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 64.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 63.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 72.41 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 70.55 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 71.4 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 25.25 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.502 ' HB3' ' HA3' ' A' ' 158' ' ' GLY . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 62.53 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 82' ' ' LYS . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 70.14 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 78' ' ' PHE . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.22 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 72.31 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.486 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 65.34 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 52.21 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 74.4 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 72.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.452 HG21 ' HG3' ' A' ' 99' ' ' ARG . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 73.31 111.824 -174.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 72.41 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.748 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.66 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 74.34 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.486 ' O ' HG22 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.66 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 72.02 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.541 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.01 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 60.13 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 65.2 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 54.13 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 61.2 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 63.11 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.472 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 55.15 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 51.35 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CD2' HD12 ' A' ' 34' ' ' LEU . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 62.23 110.63 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.407 ' HG ' HD11 ' A' ' 179' ' ' LEU . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 43.32 111.976 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 72.11 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 43.42 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.41 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.46 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 55.31 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' H ' ' HG2' ' A' ' 91' ' ' GLU . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.21 111.968 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 55.21 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 72.11 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 71.32 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.2 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 55.1 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.748 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 71.3 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.417 ' SD ' HD23 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 72.24 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.514 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 72.32 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 73.31 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.488 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 61.22 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 54.5 t60 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 71.34 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.21 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 64.22 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.506 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 45.02 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 64.42 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 63.4 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 72.54 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 44.54 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.638 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 71.34 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 54.05 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.638 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 72.2 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 54.14 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 50.53 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 34.34 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 35.13 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 72.12 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 44.54 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 42.22 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 73.4 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.518 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 71.31 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.505 ' O ' HG22 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.05 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.22 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 65.53 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 54.33 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 73.34 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 26' ' ' SER . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.478 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 71.12 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 72.14 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 65.14 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 33.51 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.41 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 62.44 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.518 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 74.31 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.422 ' CD1' HG22 ' A' ' 142' ' ' ILE . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 74.11 111.348 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 61.11 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 72.52 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 61.3 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 70.04 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 73.43 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 54.15 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 64.22 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.587 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 70.13 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.13 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 74.22 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 64.52 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 74.35 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 192' ' ' MET . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 65.01 110.572 -176.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 60.32 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 70.23 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 64.22 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 44.31 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.645 0 N-CA-C 107.737 -1.209 . . . . 71.0 107.737 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.11 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.01 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 61.25 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 65.23 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.434 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 73.15 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 54.1 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.604 ' HB2' HG11 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.1 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 71.33 110.799 -177.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 71.24 111.047 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 63.11 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.02 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.22 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 73.3 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.723 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 64.11 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.605 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.14 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.552 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 72.05 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 61.53 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 51.21 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 63.5 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 62.14 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.4 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.454 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 61.14 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.65 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 64.24 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.426 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 64.03 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 21.32 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.33 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.02 109.488 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 71.4 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 61.31 111.948 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.464 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 73.45 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 65.23 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 51.42 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 52.13 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 73.34 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 51.15 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 74.32 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 64.4 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 51.05 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 72.03 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.723 ' HG3' HG21 ' A' ' 47' ' ' THR . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 53.2 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 70.11 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 72.32 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 65.15 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 64.13 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 34' ' ' LEU . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 53.43 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 61.33 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.462 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 74.44 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.462 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 65.41 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.753 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.404 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 43.41 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 71.04 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 62.34 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.503 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 73.53 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 62.34 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 53.4 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.503 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 52.01 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' HG12 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.35 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 72.15 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 51.55 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 71.13 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.444 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 62.22 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 71.34 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 64.24 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 64.51 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASP . . . . . 0.444 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 63.23 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 63.54 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.507 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.33 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.753 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.42 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 43.1 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 41.04 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.474 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 64.14 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 62.34 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 40.11 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 74.45 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 50.44 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 71.24 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 73.23 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 176' ' ' VAL . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 53.44 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 62.01 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.42 HG12 ' O ' ' A' ' 172' ' ' LEU . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 50.25 110.742 -176.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 63.31 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 23.05 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.493 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 61.0 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.565 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 32.44 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.565 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 64.23 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 51.15 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 74.43 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 74.31 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 71.44 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 63.31 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 62.04 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 44.44 109.57 178.208 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 71.45 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.516 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 64.45 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 32' ' ' ASP . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 72.14 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HB3' ' HA ' ' A' ' 29' ' ' GLU . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 34.35 110.187 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 55.14 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 40.52 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 54.34 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.497 HH22 HD23 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 65.32 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 60.35 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 64.0 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 65.31 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 64.21 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.667 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 42.13 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 63.11 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 44.22 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 72.42 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 70.34 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.452 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 73.42 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 60.23 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 74.32 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 72.13 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 72.03 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 54.42 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.674 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 42.01 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 54.25 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 32.01 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 65.2 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 42.53 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 72.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 64.24 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.5 t60 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 62.42 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.43 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 63.34 110.828 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 73.12 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.43 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 62.01 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.401 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 74.43 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.23 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 91' ' ' GLU . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 54.11 110.778 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 43.44 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 61.22 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 40.3 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 65.44 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 63.22 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.421 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 61.35 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 72.33 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.469 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 62.42 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 61.51 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 74.11 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 52.13 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 71.12 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 53.5 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.11 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 73.53 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 72.12 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.04 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.01 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 64.55 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 71.21 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 64.24 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 65.43 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.529 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 70.01 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 71.33 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 71.14 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.603 ' HA ' HG12 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 71.22 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 65.11 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' SER . . . . . 0.425 ' HB3' ' HB ' ' A' ' 139' ' ' THR . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 62.41 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.425 ' HB ' ' HB3' ' A' ' 135' ' ' SER . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 71.43 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.529 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 54.21 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 42.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.469 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 61.23 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASP . . . . . 0.509 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 55.12 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 54.43 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.13 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.509 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 72.04 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.522 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 62.24 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 64.35 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.522 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 72.24 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 63.03 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLY . . . . . 0.516 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 43.35 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.452 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 52.42 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 43.31 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 74.4 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 53.23 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 71.31 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.473 HD22 HG22 ' A' ' 142' ' ' ILE . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 65.24 109.299 -175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 64.04 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.463 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 71.12 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 72.41 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 55.54 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 52.25 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 64.55 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.454 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 61.41 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.443 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 185' ' ' MET . . . . . 0.454 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 73.43 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 60.21 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.725 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 63.15 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.454 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 72.41 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' ASN . . . . . 0.404 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 74.0 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.725 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 73.21 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 62.15 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 . . . . . 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . . . . . . 0 N--CA 1.422 -1.836 0 CA-C-O 120.774 0.321 . . . . 64.23 110.755 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 71.24 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 71.34 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 70.25 111.128 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 61.3 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.484 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 71.32 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.31 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 71.54 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 64.45 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 64.43 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 62.25 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 53.01 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 74.34 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 64.43 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.743 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 52.42 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 73.53 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 64.52 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.647 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 64.31 110.769 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.32 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 65.32 110.623 -177.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.458 HG23 ' HB1' ' A' ' 64' ' ' ALA . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.35 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 71.14 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 73.14 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 90.0 m-20 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 64.14 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 72.34 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB1' HG23 ' A' ' 56' ' ' VAL . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 64.34 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 55.21 110.881 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 70.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.51 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.01 108.153 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 63.25 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.22 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 60.44 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 54.23 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 61.22 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 60.43 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.912 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 45.3 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 164' ' ' LEU . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 54.34 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 72.1 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 64.51 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 71.11 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 71.34 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.743 ' HG3' HG21 ' A' ' 47' ' ' THR . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 73.41 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 61.05 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.609 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 63.33 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 44.34 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 71.4 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 73.52 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.484 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 41.2 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 53.44 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 72.14 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 119' ' ' LEU . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 53.33 112.021 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 71.22 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 72.42 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 70.22 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.594 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.481 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 42.04 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.506 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.594 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 64.12 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 73.4 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 64.41 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.493 ' HA ' HG12 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 71.1 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 42.44 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' SER . . . . . 0.576 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 61.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 71.54 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 31.11 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.576 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 64.2 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 71.11 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 72.14 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 73.1 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 73.23 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASP . . . . . 0.43 ' HB2' HG23 ' A' ' 142' ' ' ILE . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.12 109.057 -176.708 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.454 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.431 ' O ' HG22 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 71.51 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 73.35 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 74.2 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.626 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 62.44 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 74.24 110.763 -176.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.1 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 54.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.04 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 71.45 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.02 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.468 HD21 ' HB ' ' A' ' 126' ' ' ILE . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 73.24 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 63.25 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 73.04 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 63.52 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.501 ' HA ' HG22 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 64.43 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' VAL . . . . . 0.501 HG22 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 70.11 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.04 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 60.32 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.461 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.43 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.461 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 53.31 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 71.21 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 63.42 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 60.32 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 63.13 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 73.1 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 50.55 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 . . . . . 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.794 0 N-CA-C 109.212 -0.662 . . . . 72.24 109.212 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 70.11 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.443 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 71.31 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 72.31 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 32.3 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 70.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 64.34 108.945 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 52.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.607 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 71.31 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 65.12 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.566 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.634 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 61.43 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 64.33 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.35 109.897 -175.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 55.23 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 61.44 112.237 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 61.21 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 71.5 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.589 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 70.32 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 63.2 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 54.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 33.51 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 72.23 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.463 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.2 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 98' ' ' ASN . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.49 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 64.41 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 70.42 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 71.33 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 65.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.414 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 33.23 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 53.23 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 63.04 111.505 178.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.02 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 74.22 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.12 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 71.42 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.455 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 72.02 107.301 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 62.15 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 72.44 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.55 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 44.05 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.468 ' HA ' HD21 ' A' ' 72' ' ' LEU . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 63.1 111.418 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.634 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 35.31 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.499 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 40.25 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 63.41 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.51 ' O ' HG23 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 63.34 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.572 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 70.24 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 43.22 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.32 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 73.13 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 63.5 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 35.51 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 55.34 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 64.51 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.625 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 64.31 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 73.01 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.625 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 51.11 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 72.03 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' A' ' 129' ' ' TRP . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 64.52 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 61.41 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 53.13 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 73.11 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 52.21 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 71.31 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.512 HG23 ' HG2' ' A' ' 143' ' ' GLN . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.11 109.389 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HA ' HD12 ' A' ' 169' ' ' LEU . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 65.3 112.594 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 62.15 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.22 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.492 ' HB2' ' HH2' ' A' ' 129' ' ' TRP . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 62.43 109.727 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 72.15 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 73.44 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 73.12 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 41.51 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 55.14 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 45.2 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 64.2 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 55.34 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 55.14 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 170' ' ' GLU . . . . . 0.456 ' H ' HD13 ' A' ' 169' ' ' LEU . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.461 ' HB2' HG12 ' A' ' 167' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 62.24 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 63.14 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 62.14 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.449 ' O ' HD13 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 64.44 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.02 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.449 HD13 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 40.14 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' SER . . . . . 0.417 ' HA ' HD11 ' A' ' 186' ' ' ILE . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 60.21 111.136 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.53 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 64.55 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' MET . . . . . 0.567 ' HA ' HG22 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.22 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 51.14 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 185' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 65.42 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.572 ' SD ' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 53.04 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 64.32 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.33 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 64.24 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 53.15 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 74.44 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 60.2 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 62.11 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 53.41 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 71.31 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 64.23 110.8 176.746 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 120.743 0.306 . . . . 73.51 111.053 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 53.3 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 82' ' ' LYS . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 64.43 110.459 176.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 65.13 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 71.5 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.48 HD21 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.13 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 70.11 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.676 HG21 ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 62.12 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 72.02 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.684 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 91.6 m-20 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 53.43 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 44.2 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.473 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 67' ' ' ILE . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 63.45 112.397 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 57' ' ' LYS . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 64.31 108.039 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 73.52 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 52.51 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 71.3 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.41 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 34.31 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.495 ' HB ' HG21 ' A' ' 56' ' ' VAL . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 63.01 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 71.24 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 72.24 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 73.12 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 38' ' ' TYR . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.619 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 53.21 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.504 ' OE1' ' HG3' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 63.55 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 62.21 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 72.31 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 73.0 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.545 HD13 HG23 ' A' ' 176' ' ' VAL . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.31 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HB3' HG23 ' A' ' 31' ' ' ILE . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.12 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.488 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 52.15 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 71.21 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 65.44 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 72.14 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 43.14 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 53.53 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.529 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.412 ' HA ' HD21 ' A' ' 72' ' ' LEU . 4.4 m-20 -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 60.0 111.26 -177.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.684 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 73.2 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 72.41 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 61.23 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 53.34 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 74.24 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 61.21 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 62.25 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 61.45 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.693 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 55.3 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.424 HG22 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 73.22 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 53.41 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 71.03 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.693 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 73.43 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.517 HD21 HG21 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.453 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 73.02 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.44 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 64.22 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.436 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 64.45 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.664 ' O ' HG12 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 130' ' ' LYS . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 72.51 107.694 171.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 61.54 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.0 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 61.2 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.575 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 72.12 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 61.54 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 41.12 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.502 HD13 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 64.01 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 64.41 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASN . . . . . 0.46 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 72.02 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASP . . . . . 0.4 ' HB2' HG23 ' A' ' 142' ' ' ILE . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 63.33 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HB2' HD13 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 64.41 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 70.1 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 72.41 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 72.45 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.14 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 65.32 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.406 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 62.21 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 70.41 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 20.23 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 73.13 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 64.14 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.419 ' HB3' HG23 ' A' ' 126' ' ' ILE . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 62.3 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 64.01 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.25 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.545 HG23 HD13 ' A' ' 81' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 52.51 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 61.33 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 72.34 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 53.44 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 53.01 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 71.04 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 45.21 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 60.31 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 43.12 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 54.2 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 64.04 109.351 178.696 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.429 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.518 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 65.23 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.22 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.518 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 54.42 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 73.54 108.977 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 71.03 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 65.13 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 63.31 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 64.54 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.733 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 42.14 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 73.45 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 74.14 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 43.1 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.532 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 61.41 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 62.12 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.431 ' HA ' HG22 ' A' ' 56' ' ' VAL . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 63.32 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' A' ' 53' ' ' ASP . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 71.54 110.276 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 62.0 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 60' ' ' LEU . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' LEU 0.262 4.7 m-20 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 63.03 113.274 -175.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 63.11 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.43 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 54.13 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.496 HD12 ' H ' ' A' ' 67' ' ' ILE . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 52.12 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.505 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 34.34 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 73.03 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 71.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.733 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 43.11 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.45 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.14 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.54 ' HE2' HD13 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.443 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 54.33 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 70.23 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.443 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 63.13 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 64.1 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 71.15 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 63.22 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.408 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 65.51 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 61.03 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 44.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 63.24 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 72.1 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 41.24 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 65.03 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.478 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 63.31 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 61.43 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 71.31 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 64.31 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 63.04 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 70.22 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.509 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 65.22 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 62.53 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.526 ' HB3' HD13 ' A' ' 27' ' ' LEU 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 119' ' ' LEU . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 71.45 110.862 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.669 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 73.31 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.04 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 60.13 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 65.54 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.516 ' HH2' ' HB2' ' A' ' 153' ' ' TRP 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 73.1 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 62.21 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HB3' ' HE3' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 41.41 109.46 175.374 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 54.11 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 64.42 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 74.1 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 54.31 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 63.33 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.474 HG21 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 62.24 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 72.55 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.44 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.442 HG21 HD21 ' A' ' 169' ' ' LEU . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 60.44 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.669 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 159' ' ' PHE . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 55.11 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.534 ' ND1' HD12 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 53.53 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.545 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 150' ' ' THR . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 71.43 110.084 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' ALA . . . . . 0.412 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 173' ' ' ALA . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 61.12 111.278 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 72.33 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.13 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 177' ' ' ASN . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 61.43 111.735 -177.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 50.14 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.489 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.14 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 73.42 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 70.43 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 189' ' ' ASN . . . . . 0.554 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 63.34 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.25 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 71.04 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' ASN . . . . . 0.416 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 50.31 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 45.11 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 63.41 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 71.11 110.409 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 40.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 63.31 110.434 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 62.01 111.172 -177.607 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 N-CA-C 109.876 -0.416 . . . . 62.32 109.876 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.506 HD13 ' HB3' ' A' ' 118' ' ' GLU . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 70.24 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 53.04 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 53.24 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.03 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 62.31 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 52.34 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 63.44 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 55.42 108.562 173.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 64.3 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 72.11 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 54.35 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.31 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.637 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 74.42 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CE2' HG22 ' A' ' 47' ' ' THR . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 71.52 109.882 175.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.21 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HA ' HG22 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 62.23 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 60.01 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 72.3 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.498 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 52.22 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 73.2 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.04 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 65.12 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 72.34 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 41.41 111.464 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.498 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 65.41 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 62.41 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 70.21 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 61.32 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 72.35 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 60.21 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 63.34 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 61.35 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 72.41 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 91' ' ' GLU . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 74.14 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 62.42 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 53.44 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.22 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 53.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.01 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 61.51 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.637 ' HG3' HG21 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 72.05 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.521 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.462 ' O ' HG23 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.05 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.702 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 54.11 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 65.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 60.01 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 64.43 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 73.21 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.506 ' HB3' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 55.22 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.482 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.45 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 54.33 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 71.14 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 72.13 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.553 HG23 HD12 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 72.1 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.618 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 52.14 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 71.43 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 43.4 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 54.44 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 53.14 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.458 HD12 ' HB2' ' A' ' 129' ' ' TRP . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 71.05 109.573 177.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.639 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 72.32 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 61.5 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.495 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 71.14 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 61.41 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 53.03 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 61.44 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 64.25 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 160' ' ' LYS . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 61.15 107.905 -178.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 62.4 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 63.12 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 72.11 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 60.02 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 63.34 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.529 ' H ' HG22 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 52.23 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 72.43 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.53 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 70.4 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 51.04 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 45.1 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 63.31 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 61.1 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 44.34 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 63.15 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 188' ' ' ILE . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 62.24 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 184' ' ' ASP . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 62.11 110.038 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 60.21 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 72.1 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 54.21 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.702 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 72.1 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 60.15 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 64.55 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 72.02 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 64.33 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 62.41 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 70.55 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 62.31 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.498 0.666 . . . . 74.24 111.643 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 33.13 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 62.01 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HE2' ' SG ' ' A' ' 86' ' ' CYS . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 73.33 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 60.32 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 82' ' ' LYS . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 70.44 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 72.21 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 70.3 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 73.42 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 73.44 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 73.22 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 61.12 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.757 HG21 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.24 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.33 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 73.43 113.849 176.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 71.42 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.499 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 85.0 m-20 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 55.12 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 50.13 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 65.21 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 64' ' ' ALA . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 53.34 112.482 -173.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 45.44 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 62.12 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.428 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 43.13 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 64.45 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 70.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 43.15 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 55.24 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 52.22 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.418 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HZ1' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 70.3 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 62.1 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 45.14 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 45.23 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 71.05 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 50.1 110.449 -176.124 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 64.54 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 60.12 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.483 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 72.12 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 61.12 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 61.42 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 64.04 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 52.22 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 54.01 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 72.53 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.602 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.401 ' HG ' ' HG3' ' A' ' 192' ' ' MET . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 71.1 111.631 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 60.04 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 64.14 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 70.42 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.487 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 63.13 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 63.03 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 71.35 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 63.45 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 43.12 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.484 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 63.31 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.428 ' O ' HG23 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 70.14 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.473 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 63.22 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 62.23 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.21 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 62.43 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 65.34 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 65.01 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.467 HD12 HD22 ' A' ' 172' ' ' LEU . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 62.14 111.495 -176.251 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.612 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 64.05 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 70.54 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 65.34 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.614 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 73.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 62.4 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.12 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 43.34 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.481 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.619 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 70.35 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.619 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 73.32 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.01 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.14 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' LEU . . . . . 0.467 HD22 HD12 ' A' ' 145' ' ' ILE . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 72.25 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.01 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 172' ' ' LEU . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 65.25 110.906 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 63.43 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 63.43 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.21 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 52.4 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 61.43 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.453 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 71.35 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 73.45 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 52.4 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 63.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.401 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 53.35 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 54.35 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 61.05 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 199' ' ' TRP . . . . . 0.45 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 64.22 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 72.44 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 71.41 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 203' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 50.14 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 65.15 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 . . . . . 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 73.45 110.104 178.972 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.22 0 N-CA-C 108.71 -0.848 . . . . 65.54 108.71 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 64.25 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 71.53 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.03 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 38.1 tp60 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.432 HG23 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 74.52 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.47 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 41.35 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 71.23 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 55.21 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 33.03 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 61.21 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 73.32 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.21 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.578 HG21 ' HG3' ' A' ' 99' ' ' ARG . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 54.01 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 63.41 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 62.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.527 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.12 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 65.41 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.447 HG11 HG12 ' A' ' 67' ' ' ILE . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 74.41 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 71.41 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 4.3 m-20 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 74.03 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 52.21 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.447 HG12 HG11 ' A' ' 56' ' ' VAL . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 60.35 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 73.5 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 53.31 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 71.34 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 65.11 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 62.21 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.427 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 71.44 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.432 ' CZ ' HG23 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 75.5 t60 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.427 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 70.13 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 61.0 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.22 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 44.22 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.03 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.573 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 71.23 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 43.14 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.578 ' HG3' HG21 ' A' ' 47' ' ' THR . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 62.22 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 74.24 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 61.24 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 52.25 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 54.11 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 62.22 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.567 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 62.14 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 70.11 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' SER . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 61.21 110.045 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 73.43 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.12 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.467 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 42.1 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 73.33 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.423 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 61.12 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 61.24 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.459 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 64.44 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 73.22 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.582 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 65.12 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.582 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 71.44 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 53.14 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 71.34 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 51.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 53.25 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 62.23 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.447 HG22 ' HG ' ' A' ' 169' ' ' LEU . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.25 108.169 -177.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ASN . . . . . 0.514 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.557 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 63.12 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.402 ' HD2' ' CG ' ' A' ' 166' ' ' ASP . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 71.41 111.362 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.431 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 62.34 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 72.22 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 64.25 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.623 ' ND1' HD12 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 63.32 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 63.43 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 64.22 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.573 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ASP . . . . . 0.557 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 142' ' ' ILE . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 63.13 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 64.11 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 72.1 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 43.13 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.454 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 63.44 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.444 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 60.52 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.444 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 70.1 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 187' ' ' TYR . . . . . 0.48 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 190' ' ' ASP . . . . . 0.554 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 43.3 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 64.11 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 194' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 63.45 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.24 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 198' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 64.53 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 199' ' ' TRP . . . . . 0.464 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 65.25 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 200' ' ' THR . . . . . 0.41 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 204' ' ' SER . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 73.13 108.762 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 203' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 204' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 201' ' ' LYS . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 . . . . . 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 44.1 111.754 179.024 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.948 0 CA-C-O 121.341 0.591 . . . . 55.04 110.903 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 64.1 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.576 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 64.34 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 71.34 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.504 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 62.41 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 50.35 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 65.14 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 63.01 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 71.01 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 55.34 110.372 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 64.15 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 63.24 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 55.0 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 74.45 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.13 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.594 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 54.55 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 45.02 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 73.23 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 63.44 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 72.14 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.42 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 71.41 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 54.44 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 42.54 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.511 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.11 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 71.1 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 62.22 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 55.52 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.31 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 64.22 109.087 169.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.695 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 60.12 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 55.05 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 54.33 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 71.24 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 72.11 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 53.04 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 64.1 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 52.34 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 61.14 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 74.31 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 65.11 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 63.24 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 54.2 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.454 ' O ' ' HA ' ' A' ' 39' ' ' SER . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 53.43 106.881 176.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 63.42 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.3 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.716 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 64.13 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 51.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.21 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.45 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 51.21 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 52.32 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 40.14 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 180' ' ' VAL . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 63.03 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.603 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 71.31 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 71.42 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 54.34 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.603 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 72.11 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.12 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 64.51 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.14 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.43 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.421 ' HA ' HG12 ' A' ' 141' ' ' VAL . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 63.22 109.435 -172.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 70.44 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 60.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 42.14 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 65.15 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 133' ' ' LYS . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 72.32 108.042 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 64.14 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 52.04 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ASN . . . . . 0.533 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 64.12 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.405 ' O ' ' HB ' ' A' ' 150' ' ' THR . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 64.12 110.322 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 54.42 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 74.31 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.439 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 72.15 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 64.12 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.403 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.47 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 71.42 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 54.03 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 63.34 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.955 ' HD1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 70.4 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.955 ' HE1' ' HD1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 72.51 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ASP . . . . . 0.533 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.403 ' H ' HD12 ' A' ' 145' ' ' ILE . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 62.51 107.918 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 126' ' ' ILE . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 61.51 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 52.42 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 60.21 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' VAL . . . . . 0.564 ' HA ' ' HE2' ' A' ' 116' ' ' HIS . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 44.32 111.222 -179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 72.32 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 54.33 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 189' ' ' ASN . . . . . 0.418 ' N ' HD12 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.23 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 41.35 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.488 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 34.21 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 193' ' ' LYS . . . . . 0.629 ' HA ' HG22 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 74.33 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 195' ' ' ASN . . . . . 0.42 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 196' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 71.11 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 61.45 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 54.12 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 62.02 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 . . . . . 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . . . . . . 0 N--CA 1.408 -2.57 0 N-CA-C 109.447 -0.575 . . . . 55.14 109.447 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' A' ' 157' ' ' HIS . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.228 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.421 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 63.21 111.518 -174.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 53.53 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.509 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 71.43 111.089 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.505 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 64.24 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.11 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 71.12 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 73.55 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 24.13 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 43.12 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 52.23 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.556 HG22 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 54.42 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 43.23 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.556 ' CZ2' HG22 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 61.44 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 102' ' ' PRO . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 71.25 107.688 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.45 ' HA ' HG22 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.554 ' O ' HD13 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.45 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 62.31 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 64.44 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 62.53 113.788 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.42 ' O ' HG22 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 60' ' ' LEU . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.13 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 HD21 ' A' ' 109' ' ' LEU . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.456 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.498 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 71.3 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.548 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.0 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.465 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.04 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 63.5 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 54.12 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 65.34 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 81' ' ' LEU . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 71.23 112.699 178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 73.31 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 81' ' ' LEU . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 74.2 110.288 175.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.442 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 72.15 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 65.25 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 65.3 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 62.23 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 55.41 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 71.42 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 53.5 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.548 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.476 ' HA ' HD21 ' A' ' 72' ' ' LEU . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.537 ' HG3' HG21 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 72.52 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 72.0 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.463 ' HA ' HG23 ' A' ' 52' ' ' THR . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 71.12 114.883 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 45.03 112.019 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 72.11 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.458 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 73.2 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 71.24 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 70.32 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 62.42 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 73.01 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 70.45 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' SER . . . . . 0.406 ' HB3' HG21 ' A' ' 180' ' ' VAL . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.02 111.423 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 55.55 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 71.31 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 73.24 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.03 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.535 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.535 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 127' ' ' ASP . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 73.4 109.353 171.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 131' ' ' LYS . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 74.15 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.62 ' HA ' HG12 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 61.42 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.549 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 74.42 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 45.22 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.483 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.409 ' HA ' HD22 ' A' ' 169' ' ' LEU . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.449 HG22 ' H ' ' A' ' 167' ' ' VAL . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 31.31 110.244 177.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 71.3 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ASP . . . . . 0.487 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 41.42 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 65.55 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ASN . . . . . 0.445 ' O ' HG22 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.42 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' TRP . . . . . 0.477 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 64.12 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 50.12 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' HIS . . . . . 0.404 ' O ' ' HB3' ' A' ' 26' ' ' SER . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 45.12 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.23 111.42 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LYS . . . . . 0.538 ' HB3' ' HG2' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 73.41 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' ASN . . . . . 0.451 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.449 ' H ' HG22 ' A' ' 145' ' ' ILE . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 71.13 107.535 -176.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 72.2 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 72.32 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 44.4 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 62.12 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.24 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ASN . . . . . 0.46 ' HA ' HG12 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 71.54 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 52.14 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 51.31 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' VAL . . . . . 0.46 HG12 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 182' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 70.41 108.466 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 64.51 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 71.4 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' ILE . . . . . 0.591 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 62.13 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 192' ' ' MET . . . . . 0.591 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 54.12 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 61.55 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 73.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.42 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 199' ' ' TRP . . . . . 0.456 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 54.32 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 61.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 70.1 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 203' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 . . . . . 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.241 0.643 0 N-CA-C 111.844 0.313 . . . . 45.3 111.844 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -75.86 -34.11 60.03 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.901 0.704 . . . . 61.33 112.901 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -164.47 -161.97 14.56 Favored Glycine 0 CA--C 1.477 -2.292 0 C-N-CA 120.279 -0.962 . . . . 73.53 110.93 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.9 mt -84.22 109.97 18.22 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.992 0 N-CA-C 106.405 -1.702 . . . . 74.2 106.405 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -130.16 120.62 24.85 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.94 -0.704 . . . . 73.03 110.999 -175.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -122.78 -98.45 1.41 Allowed Glycine 0 N--CA 1.417 -2.62 0 N-CA-C 109.077 -1.609 . . . . 60.14 109.077 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.1 t -154.07 108.49 3.05 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.958 -1.127 . . . . 72.51 107.958 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -81.19 105.83 12.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 116.177 -0.465 . . . . 64.43 110.799 -178.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -134.13 159.15 41.72 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 109.63 -0.507 . . . . 73.3 109.63 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -87.55 145.79 26.07 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.174 -1.417 . . . . 60.23 107.174 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.27 -13.55 37.83 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.653 0.612 . . . . 74.24 112.653 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -110.81 158.31 18.82 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.105 0.478 . . . . 75.13 110.06 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -112.87 110.06 19.91 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 107.218 -1.401 . . . . 74.41 107.218 174.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -74.07 -48.49 29.45 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.118 -0.946 . . . . 75.33 110.406 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.7 m -76.08 102.48 5.71 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.16 -0.927 . . . . 51.14 111.653 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 64.5 t -103.05 100.85 11.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.648 -1.241 . . . . 64.21 107.648 174.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.7 t -74.06 102.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 108.758 -0.83 . . . . 74.24 108.758 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.85 153.57 23.95 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.779 -0.646 . . . . 71.2 110.066 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.79 103.68 0.88 Allowed Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.129 -0.789 . . . . 63.21 111.129 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.29 112.69 20.53 Favored 'General case' 0 N--CA 1.425 -1.72 0 N-CA-C 109.922 -0.399 . . . . 74.42 109.922 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.1 t -78.79 116.48 19.16 Favored 'General case' 0 N--CA 1.419 -2.013 0 N-CA-C 108.198 -1.038 . . . . 62.54 108.198 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.9 m -69.19 111.13 4.93 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.355 -0.839 . . . . 61.13 111.945 -176.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 63.4 t -77.51 110.49 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 107.129 -1.434 . . . . 63.14 107.129 174.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 75.05 109.96 0.07 Allowed 'General case' 0 C--O 1.248 0.975 0 C-N-CA 125.422 1.489 . . . . 73.04 109.054 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.34 170.32 16.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.964 -0.562 . . . . 53.1 109.701 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.24 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.544 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 61.2 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 53.5 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.499 ' HB ' ' CZ ' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 60.14 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 64.43 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 53.34 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 54.4 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 50.1 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 74.44 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 73.25 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 54.01 111.997 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 65.34 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 62.11 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 52.32 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 72.21 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.552 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 50.32 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 64.04 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 61.1 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 71.03 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.587 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 61.12 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 34.11 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.666 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 61.24 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.24 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 72.51 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 54.43 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 HG21 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 63.2 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CZ ' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 64.24 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 72.11 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 71.21 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 64.03 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.423 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 61.44 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 72.14 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.478 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 71.1 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 70.04 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 53.12 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 63.22 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 39' ' ' SER . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 51.13 105.956 175.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.429 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 43.22 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 62.24 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 63.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 64.41 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 72.33 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 52.11 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 64.33 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.418 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 70.13 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.465 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 72.21 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.609 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 54.05 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 51.12 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 60.41 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.518 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 72.04 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 62.14 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.636 ' HD2' HG11 ' A' ' 180' ' ' VAL . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 44.32 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.489 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 71.33 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.52 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.458 ' N ' HD12 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 53.34 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.52 ' HE1' HG22 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 70.4 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.12 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 129' ' ' TRP . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 63.22 108.814 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 72.31 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 71.35 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 53.23 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.532 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 64.45 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 65.42 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 129' ' ' TRP . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.23 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 72.33 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.593 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.437 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.5 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.568 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 65.51 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.482 ' O ' HG22 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.489 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.42 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.482 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 51.31 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 73.2 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 70.22 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 65.53 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 63.23 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.423 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 55.43 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ASP . . . . . 0.593 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 54.53 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 62.32 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 64.13 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 53.52 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 65.31 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 70.33 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' VAL . . . . . 0.636 HG11 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 41.14 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 186' ' ' ILE . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 63.31 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 70.43 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 61.44 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 72.33 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 181' ' ' SER . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.45 HG21 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.03 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.609 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 71.1 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 73.24 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 64.15 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.3 108.795 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 64.23 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 74.51 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 45.22 110.412 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -66.46 -35.18 79.64 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.18 -47.8 78.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.792 -0.818 . . . . 73.4 108.792 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.04 -40.44 94.78 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.908 -0.587 . . . . 75.22 109.761 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.3 ttt -63.65 -40.38 96.72 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.468 -0.787 . . . . 64.33 111.2 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.4 mmt -77.21 -26.67 52.99 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.754 -0.778 . . . . 73.52 112.118 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.83 19.19 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.162 0.506 . . . . 53.2 110.637 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -85.99 -43.21 13.35 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 113.409 0.892 . . . . 64.14 113.409 -175.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.81 -48.76 5.34 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.638 -0.505 . . . . 72.13 109.638 -172.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -79.77 173.85 55.09 Favored Glycine 0 N--CA 1.424 -2.161 0 CA-C-N 115.463 -0.79 . . . . 65.15 113.581 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 8.8 tt -139.57 113.1 6.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.751 -1.203 . . . . 74.42 107.751 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 108.34 0.72 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.649 -0.705 . . . . 63.21 111.504 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -88.27 -159.27 34.56 Favored Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.871 -0.604 . . . . 75.14 112.372 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -79.21 86.9 4.95 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.484 0.659 . . . . 52.32 111.206 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -124.29 160.52 27.84 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.414 -0.812 . . . . 74.2 109.852 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -140.55 -78.77 0.06 OUTLIER Glycine 0 N--CA 1.422 -2.263 0 N-CA-C 108.452 -1.859 . . . . 63.53 108.452 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -162.45 140.04 8.32 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.562 -0.903 . . . . 45.42 108.562 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -99.49 152.81 19.59 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.303 -1.369 . . . . 74.32 107.303 176.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.312 -1.038 0 CA-C-O 117.78 -1.105 . . . . 62.31 110.378 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.241 0.641 0 CA-C-O 119.822 -0.133 . . . . 53.44 110.878 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.2 m 72.79 141.49 0.06 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.346 1.058 . . . . 70.21 111.352 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.84 166.38 26.61 Favored Glycine 0 N--CA 1.424 -2.104 0 C-N-CA 120.373 -0.917 . . . . 74.21 111.091 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.2 tt -97.92 136.89 27.14 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 108.975 -0.75 . . . . 74.32 108.975 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -159.95 140.47 11.96 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 110.142 -0.318 . . . . 71.21 110.142 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 101.03 83.02 1.71 Allowed Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 120.707 -0.759 . . . . 71.23 112.513 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.8 m -115.04 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 107.808 -1.182 . . . . 63.14 107.808 176.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -134.73 101.21 4.85 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.995 -0.548 . . . . 74.25 110.887 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.72 85.07 1.69 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 104.696 -2.335 . . . . 71.42 104.696 174.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -150.86 74.36 1.16 Allowed 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.123 -1.398 . . . . 70.14 108.624 -174.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -89.75 -57.64 2.8 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.17 -0.923 . . . . 44.15 109.258 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.0 mttp 63.55 103.06 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.603 -1.18 . . . . 74.04 110.947 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -80.35 103.01 9.92 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.327 0.584 . . . . 65.51 110.154 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.61 -51.51 69.11 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.09 -1.414 . . . . 53.12 110.555 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m 47.55 81.31 0.04 OUTLIER 'General case' 0 C--O 1.243 0.749 0 N-CA-C 114.937 1.458 . . . . 75.35 114.937 174.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.2 t -113.06 101.15 12.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.127 -1.064 . . . . 75.3 108.127 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.9 t -113.62 101.2 12.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-N 115.742 -0.663 . . . . 72.44 109.69 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -107.98 117.71 34.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.712 -1.218 . . . . 65.21 107.712 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.31 54.22 0.54 Allowed Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 111.179 -0.768 . . . . 44.44 111.179 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.42 99.72 2.05 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 121.555 0.693 . . . . 71.14 110.835 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.6 m -117.1 156.89 26.83 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 106.585 -1.635 . . . . 25.35 106.585 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.9 m -67.65 95.83 0.51 Allowed 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 121.393 0.616 . . . . 63.25 110.133 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.4 m -95.63 14.06 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 124.087 1.898 . . . . 75.55 109.773 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -131.48 107.54 8.96 Favored 'General case' 0 C--N 1.25 -3.751 0 N-CA-C 100.79 -3.781 . . . . 73.43 100.79 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.63 165.94 20.62 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 115.473 -0.785 . . . . 75.14 111.327 -169.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 64.12 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.2 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.456 ' HG3' HG13 ' A' ' 111' ' ' VAL . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 71.44 109.33 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.479 HD13 ' HE2' ' A' ' 82' ' ' LYS . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.531 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 70.24 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' HG11 ' A' ' 111' ' ' VAL . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 63.52 110.926 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 70.13 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 55.52 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 65.22 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 55.45 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 53.32 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 71.51 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.693 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 73.11 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 72.41 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.593 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 64.21 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.666 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 64.53 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.469 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 55.32 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.22 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 53.33 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 54.12 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 55.25 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 65.42 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 72.31 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 62.41 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 70.11 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 63.21 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 61.34 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.41 ' O ' HG23 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.04 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.412 HD12 HD21 ' A' ' 179' ' ' LEU . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.479 ' HE2' HD13 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 53.54 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 64.03 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 70.04 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 65.22 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 91' ' ' GLU . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 73.52 110.411 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 73.12 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 62.44 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 74.54 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 53.11 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 65.32 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 108' ' ' MET . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.515 ' O ' HG23 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 63.41 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 104' ' ' ASP . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 72.13 110.949 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.531 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 73.2 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.464 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 44.32 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 64.22 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 63.44 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 71.24 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.405 ' HG ' HG13 ' A' ' 176' ' ' VAL . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 64.01 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' HG11 ' A' ' 176' ' ' VAL . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 73.21 111.193 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 73.32 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.44 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 41.44 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 72.33 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 63.42 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 65.45 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.34 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 64.21 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 74.31 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 62.42 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 73.01 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.54 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 51.24 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 73.23 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 63.02 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.479 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.451 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 70.23 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 44.14 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 63.04 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.456 ' HA ' ' HG3' ' A' ' 28' ' ' LYS . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 60.41 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 72.2 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 61.53 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.506 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 74.54 110.938 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 51.01 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 74.34 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 72.43 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 55.22 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 45.31 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.55 HG11 ' HB2' ' A' ' 123' ' ' LYS . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.412 HD21 HD12 ' A' ' 81' ' ' LEU . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.13 113.144 -179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 61.33 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 185' ' ' MET . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.12 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' MET . . . . . 0.455 ' HB3' ' HB3' ' A' ' 182' ' ' HIS . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 50.2 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 71.21 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 64.2 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 60.2 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 199' ' ' TRP . . . . . 0.485 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 74.01 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 203' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 72.21 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 -75.57 -29.19 59.25 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.43 111.576 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.58 -39.68 64.46 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.489 -0.484 . . . . 70.12 111.0 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.96 84.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.603 -0.517 . . . . 73.35 109.603 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.4 ttt -61.17 -39.68 91.03 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.296 -0.866 . . . . 71.52 110.784 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' MET . . . . . 0.579 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 22.1 ttt -71.01 -39.46 72.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.855 -0.611 . . . . 72.43 110.153 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.9 -38.6 79.69 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 116.119 -0.491 . . . . 70.02 110.576 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -23.32 64.22 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 75.44 111.396 177.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -70.95 -46.27 62.71 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.653 -0.499 . . . . 74.53 109.653 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 131.41 -30.66 3.26 Favored Glycine 0 CA--C 1.502 -0.767 0 C-N-CA 120.653 -0.784 . . . . 72.23 111.706 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ILE . . . . . 0.579 ' O ' ' HG2' ' A' ' 210' ' ' MET . 2.5 mp -98.34 117.35 43.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 N-CA-C 107.748 -1.204 . . . . 72.43 107.748 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 28.1 t -103.18 166.33 10.5 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.503 -0.925 . . . . 75.22 108.503 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -155.13 173.74 33.38 Favored Glycine 0 N--CA 1.427 -1.911 0 N-CA-C 110.906 -0.878 . . . . 74.01 110.906 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -137.56 142.47 41.36 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 109.927 -0.397 . . . . 72.22 109.927 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -152.5 103.9 2.86 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.058 0.456 . . . . 72.14 110.78 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -123.67 147.75 16.67 Favored Glycine 0 C--N 1.288 -2.104 0 N-CA-C 107.298 -2.321 . . . . 73.3 107.298 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.84 106.53 8.57 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 118.386 1.093 . . . . 70.21 112.231 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -85.56 -29.81 23.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 105.243 -2.132 . . . . 63.1 105.243 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 N--CA 1.431 -1.419 0 N-CA-C 104.734 -2.321 . . . . 75.24 104.734 173.539 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.438 -1.069 0 N-CA-C 109.552 -0.536 . . . . 54.44 109.552 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -82.85 161.93 21.77 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 116.076 -0.511 . . . . 71.25 110.866 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.25 171.04 33.97 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.126 -1.19 . . . . 52.45 110.126 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.96 118.99 2.31 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 N-CA-C 108.223 -1.028 . . . . 74.25 108.223 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -103.32 113.24 26.58 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 104.689 -2.337 . . . . 64.11 104.689 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -111.41 41.36 2.26 Favored Glycine 0 N--CA 1.432 -1.574 0 C-N-CA 119.704 -1.236 . . . . 54.31 115.116 -171.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.1 t -73.97 97.2 2.78 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.593 -1.262 . . . . 72.14 107.593 172.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -108.74 123.11 48.49 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 121.758 0.79 . . . . 63.43 111.451 -174.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -115.01 140.24 49.21 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 106.618 -1.623 . . . . 73.11 106.618 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.18 165.72 22.14 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 120.16 -0.616 . . . . 64.5 110.124 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -46.04 -57.65 4.26 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 115.977 1.843 . . . . 62.23 115.977 -170.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 61.87 173.36 0.12 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.266 0.839 . . . . 71.32 113.266 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.05 138.07 0.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.2 1.4 . . . . 73.31 107.655 170.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.97 -56.16 3.83 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.477 -0.934 . . . . 62.34 108.477 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -168.44 120.5 0.82 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.305 -1.369 . . . . 72.45 107.305 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.9 t -84.19 97.99 5.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.085 -1.079 . . . . 73.33 108.085 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -82.14 137.32 21.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-N 115.625 -0.716 . . . . 63.11 109.534 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -134.27 147.03 50.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.796 -0.816 . . . . 63.22 108.796 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' H ' ' HA3' ' A' ' 220' ' ' GLY . . . 63.97 49.21 69.0 Favored Glycine 0 N--CA 1.45 -0.426 0 O-C-N 123.866 0.729 . . . . 61.21 113.014 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.6 102.98 3.89 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.14 0.495 . . . . 63.55 110.646 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.7 t -166.68 171.8 11.22 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 108.503 -0.925 . . . . 72.12 108.503 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -83.34 88.01 6.96 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-O 121.297 0.57 . . . . 55.04 109.67 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.41 ' O ' ' HB3' ' A' ' 24' ' ' GLU . 48.4 t -83.23 106.78 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 107.525 -1.287 . . . . 61.41 107.525 175.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' VAL . 34.4 tt0 75.29 126.01 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 O-C-N 124.903 1.377 . . . . 71.13 110.886 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.62 174.99 3.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.925 -0.58 . . . . 75.3 110.459 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 71.02 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 73.23 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 112' ' ' LEU . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 53.22 109.374 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 71.2 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.404 ' HB2' ' CD2' ' A' ' 79' ' ' HIS . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 62.13 111.817 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 52.4 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.548 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 64.53 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.529 HG21 ' HG3' ' A' ' 99' ' ' ARG . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.519 ' O ' HG22 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 53.41 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 61.25 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.3 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 71.41 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 60.25 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 41.23 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.411 ' O ' HG22 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.11 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 43.11 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 73.03 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 HG23 ' A' ' 67' ' ' ILE . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.22 110.767 179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 71.42 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 71.52 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 62.32 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 73.24 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.404 ' CD2' ' HB2' ' A' ' 39' ' ' SER . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 71.15 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 73.31 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 71.12 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 65.34 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 53.24 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.2 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 63.03 111.376 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.1 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 63.15 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 41.12 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 63.53 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 71.04 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.525 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.13 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 53.24 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 61.22 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.657 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 45.24 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 62.12 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 60.11 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.439 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 64.1 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 52.52 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 53.34 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.432 HD21 HD11 ' A' ' 172' ' ' LEU . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 54.02 108.749 172.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.476 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.463 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 65.05 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 132' ' ' VAL . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 70.53 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 72.44 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HA ' HG12 ' A' ' 141' ' ' VAL . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 70.22 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 62.3 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 61.2 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 74.31 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 143' ' ' GLN . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 62.42 108.727 172.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.501 ' HG2' HG23 ' A' ' 141' ' ' VAL . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.419 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 71.3 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 63.44 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 63.24 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 73.33 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 64.51 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.554 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 54.34 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.486 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 62.44 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.481 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 73.0 109.525 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 72.2 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 122' ' ' LEU . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 72.1 110.814 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 72.52 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 173' ' ' ALA . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 71.44 109.468 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 73.23 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.11 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 70.01 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.498 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 62.15 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 74.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 65.45 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 64.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 63.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 72.41 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 70.55 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 71.4 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 25.25 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -63.56 -45.13 91.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.3 -41.61 96.77 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.14 -0.482 . . . . 64.13 110.483 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.59 95.23 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.063 -0.517 . . . . 71.41 111.17 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -73.21 -33.02 65.13 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.419 -0.513 . . . . 73.23 110.792 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.9 ttt -70.06 -40.97 74.75 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.883 -0.599 . . . . 73.52 110.034 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.93 -18.61 62.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.758 -0.655 . . . . 64.32 111.254 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' HA ' ' OE1' ' A' ' 212' ' ' GLU . 4.4 tp10 -84.02 -33.47 24.51 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.294 -0.562 . . . . 73.25 109.818 175.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 14.9 mm-40 -66.86 -50.37 62.73 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.478 -0.564 . . . . 73.5 109.478 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -161.57 -107.14 0.21 Allowed Glycine 0 N--CA 1.425 -2.078 0 N-CA-C 109.406 -1.478 . . . . 64.4 109.406 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 48.0 pt -130.96 171.96 17.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 C-N-CA 120.032 -0.667 . . . . 64.41 110.693 177.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.3 t -127.7 94.26 3.91 Favored 'General case' 0 N--CA 1.411 -2.419 0 N-CA-C 105.568 -2.012 . . . . 52.44 105.568 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -58.96 132.62 52.64 Favored Glycine 0 C--O 1.253 1.31 0 CA-C-N 115.157 -0.929 . . . . 64.15 112.322 -177.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -158.71 178.67 9.86 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.487 -1.301 . . . . 61.43 107.487 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -156.47 94.99 1.53 Allowed 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 109.413 -0.588 . . . . 72.12 109.413 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' GLY . . . . . 0.461 ' HA3' ' H ' ' A' ' 19' ' ' GLY . . . -80.94 53.38 4.6 Favored Glycine 0 C--N 1.303 -1.253 0 CA-C-N 115.664 -0.698 . . . . 50.23 113.102 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -135.63 81.97 1.92 Allowed 'General case' 0 C--N 1.288 -2.096 0 N-CA-C 104.016 -2.587 . . . . 75.15 104.016 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -47.21 -63.38 1.06 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 113.11 -1.859 . . . . 61.41 112.542 -173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 . . . . . 0 C--N 1.288 -2.093 0 N-CA-C 108.613 -0.884 . . . . 71.15 108.613 -177.66 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.801 0.334 . . . . 75.32 110.104 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.1 m -157.41 147.54 20.75 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.537 -0.912 . . . . 51.13 108.537 176.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.55 160.22 21.57 Favored Glycine 0 CA--C 1.49 -1.478 0 N-CA-C 110.259 -1.136 . . . . 74.44 110.259 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.1 tt -147.04 93.43 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 CA-C-O 122.376 1.084 . . . . 70.22 112.333 -176.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -124.43 122.38 37.48 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.095 -2.187 . . . . 72.41 105.095 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.87 113.89 1.37 Allowed Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.292 -0.956 . . . . 51.34 112.075 -177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -147.42 65.67 1.13 Allowed 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 106.368 -1.716 . . . . 60.13 106.368 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 t -134.35 -169.13 2.27 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.443 -1.253 . . . . 54.13 108.429 -174.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -148.43 152.61 37.26 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.662 -0.495 . . . . 73.2 109.662 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -139.18 123.57 18.22 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 108.255 -1.017 . . . . 75.23 108.255 175.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -77.16 -48.78 16.75 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 105.118 -2.179 . . . . 73.54 105.118 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' A' ' 12' ' ' LYS 0.346 41.0 mmtt 61.47 67.81 0.76 Allowed 'General case' 0 N--CA 1.418 -2.042 0 CA-C-N 112.609 -2.087 . . . . 74.52 114.439 -176.295 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.8 ttp180 -118.12 82.61 1.87 Allowed 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 106.756 -1.572 . . . . 73.11 106.756 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -83.61 -47.78 10.91 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.189 -1.412 . . . . 71.22 107.189 175.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m 30.29 66.52 0.13 Allowed 'General case' 0 C--N 1.347 0.482 0 O-C-N 125.656 1.848 . . . . 75.22 114.175 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.15 95.08 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.773 0 N-CA-C 107.757 -1.201 . . . . 72.2 107.757 178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.7 p -79.4 81.99 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-O 122.823 1.297 . . . . 61.12 110.514 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -123.33 97.2 5.3 Favored 'General case' 0 N--CA 1.414 -2.259 0 N-CA-C 106.044 -1.836 . . . . 61.02 106.044 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.98 40.54 0.8 Allowed Glycine 0 CA--C 1.475 -2.429 0 N-CA-C 108.945 -1.662 . . . . 74.24 108.945 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.63 139.82 50.89 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.704 -0.748 . . . . 62.22 109.395 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.1 p -108.94 165.67 11.4 Favored 'General case' 0 C--N 1.278 -2.52 0 CA-C-N 115.606 -0.725 . . . . 72.21 109.834 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.5 m -71.96 101.69 2.75 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.992 -0.744 . . . . 64.21 108.992 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.62 119.6 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 109.63 -0.508 . . . . 55.22 109.63 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 77.61 152.39 0.13 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.183 1.393 . . . . 75.14 109.876 -175.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.52 176.22 5.23 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.502 ' HB3' ' HA3' ' A' ' 158' ' ' GLY . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 62.53 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 82' ' ' LYS . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 70.14 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 78' ' ' PHE . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.22 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 72.31 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.486 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 65.34 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 52.21 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 74.4 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 72.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.452 HG21 ' HG3' ' A' ' 99' ' ' ARG . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 73.31 111.824 -174.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 72.41 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.748 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.66 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 74.34 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.486 ' O ' HG22 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.66 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 72.02 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.541 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.01 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 60.13 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 65.2 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 54.13 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 61.2 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 63.11 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.472 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 55.15 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 51.35 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CD2' HD12 ' A' ' 34' ' ' LEU . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 62.23 110.63 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.407 ' HG ' HD11 ' A' ' 179' ' ' LEU . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 43.32 111.976 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 72.11 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 43.42 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.41 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.46 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 55.31 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' H ' ' HG2' ' A' ' 91' ' ' GLU . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.21 111.968 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 55.21 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 72.11 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 71.32 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.2 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 55.1 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.748 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 71.3 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.417 ' SD ' HD23 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 72.24 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.514 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 72.32 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 73.31 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.488 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 61.22 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 54.5 t60 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 71.34 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.21 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 64.22 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.506 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 45.02 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 64.42 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 63.4 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 72.54 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 44.54 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.638 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 71.34 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 54.05 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.638 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 72.2 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 54.14 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 50.53 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 34.34 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 35.13 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 72.12 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 44.54 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 42.22 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 73.4 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.518 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 71.31 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.505 ' O ' HG22 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.05 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.22 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 65.53 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 54.33 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 73.34 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 26' ' ' SER . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.478 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 71.12 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 72.14 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 65.14 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 33.51 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.41 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 62.44 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.518 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 74.31 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.422 ' CD1' HG22 ' A' ' 142' ' ' ILE . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 74.11 111.348 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 61.11 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 72.52 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 61.3 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 70.04 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 73.43 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 54.15 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 64.22 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.587 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 70.13 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.13 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 74.22 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 64.52 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 74.35 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 192' ' ' MET . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 65.01 110.572 -176.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 60.32 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 70.23 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 64.22 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 44.31 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 -66.19 -36.19 82.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -66.26 -46.11 78.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.378 -0.828 . . . . 73.24 109.401 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.25 -42.08 98.01 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 120.982 0.42 . . . . 65.13 111.911 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.74 -34.67 67.2 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.614 -0.434 . . . . 72.32 110.804 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 51.2 ttp -73.87 -31.02 62.95 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.378 -0.373 . . . . 63.51 110.262 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.31 -32.36 72.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.344 0.593 . . . . 74.03 110.676 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.32 -38.65 26.41 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 115.837 -0.62 . . . . 72.04 109.726 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -63.71 -41.95 98.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.694 -0.685 . . . . 51.21 111.383 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -168.78 -119.67 0.5 Allowed Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 120.979 -0.629 . . . . 73.14 111.972 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.68 142.39 21.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 108.828 -0.804 . . . . 74.51 108.828 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.8 m -120.77 175.54 5.98 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 116.6 -0.273 . . . . 75.14 110.482 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 143.84 140.89 3.71 Favored Glycine 0 N--CA 1.427 -1.913 0 N-CA-C 108.689 -1.764 . . . . 71.12 108.689 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.61 -67.97 0.43 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 117.246 0.523 . . . . 63.12 109.604 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 55.9 tptt 170.09 116.25 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 124.937 1.295 . . . . 74.5 108.055 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -78.97 85.02 1.21 Allowed Glycine 0 N--CA 1.437 -1.248 0 N-CA-C 109.354 -1.499 . . . . 63.31 109.354 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -78.78 -41.03 31.55 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.765 -0.828 . . . . 71.51 108.765 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -116.76 104.38 11.28 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.163 -0.926 . . . . 75.3 109.184 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--O 1.251 1.143 0 N-CA-C 107.659 -1.237 . . . . 73.5 107.659 179.442 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.947 -0.76 . . . . 73.22 108.947 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 p -142.13 147.28 36.41 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 110.001 -0.37 . . . . 53.53 110.001 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.47 175.46 21.2 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.314 -1.114 . . . . 63.42 110.314 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.3 tt -162.22 99.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 CA-C-O 121.956 0.884 . . . . 70.32 110.688 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.38 117.91 30.65 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.117 -0.947 . . . . 74.14 108.807 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -84.68 123.58 6.33 Favored Glycine 0 N--CA 1.432 -1.582 0 CA-C-N 116.044 -0.525 . . . . 32.4 112.487 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -133.0 86.79 2.34 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 109.337 -0.616 . . . . 72.2 109.337 177.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -153.42 115.37 4.31 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.904 -0.589 . . . . 73.35 109.951 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.8 143.7 48.71 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.86 -0.793 . . . . 75.42 108.86 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -119.79 149.69 41.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.971 -0.751 . . . . 72.35 108.971 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.54 -32.44 67.09 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.538 0.524 . . . . 75.43 112.139 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 49.62 67.54 0.88 Allowed 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.918 0.887 . . . . 72.43 111.614 -176.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.5 mtt180 -78.56 139.99 38.55 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.892 -1.049 . . . . 74.22 111.241 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -80.86 -15.19 57.0 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.898 -0.592 . . . . 72.41 110.561 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.5 m 75.8 82.43 0.1 Allowed 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.969 1.308 . . . . 72.34 111.959 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.9 p -82.02 89.6 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 CA-C-O 122.698 1.237 . . . . 51.54 108.74 176.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.87 160.34 35.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-N 114.357 -1.292 . . . . 71.03 108.742 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.38 126.94 48.22 Favored 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 107.951 -1.129 . . . . 74.13 107.951 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.28 116.81 5.26 Favored Glycine 0 C--N 1.303 -1.26 0 N-CA-C 110.718 -0.953 . . . . 75.41 110.718 -179.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -104.42 132.03 51.13 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.064 0.459 . . . . 62.42 111.477 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.1 t -145.02 160.77 40.84 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 106.744 -1.576 . . . . 74.43 106.744 175.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -83.12 98.32 9.27 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 120.664 0.269 . . . . 63.25 110.456 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -79.6 119.34 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.608 0 CA-C-O 121.158 0.504 . . . . 72.03 110.411 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 66.9 96.6 0.06 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 114.731 -1.122 . . . . 62.42 111.875 -174.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.75 167.59 20.53 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 114.534 -1.212 . . . . 71.0 107.737 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.11 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.01 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 61.25 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 65.23 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.434 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 73.15 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 54.1 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.604 ' HB2' HG11 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.1 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 71.33 110.799 -177.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 71.24 111.047 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 63.11 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.02 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.22 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 73.3 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.723 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 64.11 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.605 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.14 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.552 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 72.05 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 61.53 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 51.21 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 63.5 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 62.14 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.4 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.454 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 61.14 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.65 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 64.24 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.426 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 64.03 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 21.32 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.33 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.02 109.488 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 71.4 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 61.31 111.948 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.464 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 73.45 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 65.23 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 51.42 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 52.13 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 73.34 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 51.15 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 74.32 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 64.4 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 51.05 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 72.03 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.723 ' HG3' HG21 ' A' ' 47' ' ' THR . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 53.2 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 70.11 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 72.32 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 65.15 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 64.13 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 34' ' ' LEU . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 53.43 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 61.33 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.462 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 74.44 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.462 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 65.41 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.753 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.404 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 43.41 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 71.04 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 62.34 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.503 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 73.53 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 62.34 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 53.4 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.503 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 52.01 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' HG12 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.35 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 72.15 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 51.55 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 71.13 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.444 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 62.22 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 71.34 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 64.24 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 64.51 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.444 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 63.23 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 63.54 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.507 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.33 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.753 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.42 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 43.1 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 41.04 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.474 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 64.14 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 62.34 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 40.11 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 74.45 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 50.44 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 71.24 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 73.23 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 176' ' ' VAL . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 53.44 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 62.01 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.42 HG12 ' O ' ' A' ' 172' ' ' LEU . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 50.25 110.742 -176.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 63.31 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 23.05 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.493 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 61.0 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.565 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 32.44 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.565 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 64.23 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 51.15 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 74.43 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 74.31 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 71.44 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 63.31 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 62.04 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -64.11 -46.83 82.44 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 44.44 109.57 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.23 -40.61 96.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.479 -0.328 . . . . 74.32 110.679 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.09 85.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.007 0.432 . . . . 74.22 111.279 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 49.2 ttm -69.98 -40.61 75.25 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 74.14 110.057 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 56.4 ttp -67.71 -40.98 84.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.828 -0.624 . . . . 64.24 109.776 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.78 -27.24 66.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.058 -0.519 . . . . 72.04 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -79.03 -49.06 13.3 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.896 -0.593 . . . . 70.14 109.713 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -58.16 5.59 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.255 -0.884 . . . . 61.31 112.105 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -149.08 111.04 0.51 Allowed Glycine 0 N--CA 1.425 -2.036 0 C-N-CA 120.066 -1.064 . . . . 63.1 111.539 -176.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 2.7 mp -64.39 117.03 4.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.981 -0.748 . . . . 72.33 108.981 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.1 t -84.66 150.96 24.79 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 109.256 -0.646 . . . . 63.33 109.256 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -81.51 134.15 12.85 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.916 -0.874 . . . . 43.32 110.916 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -80.19 117.15 20.73 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.27 -0.641 . . . . 54.52 109.27 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -127.2 133.11 50.32 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.14 -0.689 . . . . 74.33 109.14 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 174.05 177.83 43.53 Favored Glycine 0 N--CA 1.417 -2.575 0 N-CA-C 110.513 -1.035 . . . . 71.13 110.513 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.61 148.49 25.94 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 110.11 -0.33 . . . . 62.55 110.11 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 63.1 tttp 177.19 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.725 -1.213 . . . . 72.14 107.725 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 C--N 1.318 -0.779 0 N-CA-C 107.398 -1.334 . . . . 73.32 107.398 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.429 -1.514 0 N-CA-C 109.138 -0.69 . . . . 64.05 109.138 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 p -134.72 148.15 50.22 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.451 -0.574 . . . . 72.0 109.451 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 147.3 174.52 19.38 Favored Glycine 0 N--CA 1.436 -1.302 0 N-CA-C 111.601 -0.599 . . . . 72.25 111.601 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.1 tt -131.23 109.09 15.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-O 121.9 0.857 . . . . 73.53 108.747 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -107.71 152.07 24.82 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.49 -0.777 . . . . 75.33 110.651 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.36 87.34 0.28 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.597 -0.811 . . . . 74.13 111.118 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -147.45 102.7 3.48 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.74 -0.467 . . . . 72.34 109.74 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.1 t -128.42 119.07 24.25 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.522 -0.918 . . . . 63.13 108.522 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -109.9 109.72 20.44 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.638 0.732 . . . . 61.32 110.832 -179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.22 109.3 20.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.807 -1.553 . . . . 63.34 106.807 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.24 -47.53 68.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.075 0.95 . . . . 73.14 113.552 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.3 mttm 60.34 70.05 0.65 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.89 0.876 . . . . 74.12 111.296 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -93.17 108.6 20.18 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.244 -1.021 . . . . 74.43 108.244 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.529 ' O ' HG23 ' A' ' 16' ' ' VAL . 6.5 p-10 -79.17 -6.29 56.21 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.514 0.931 . . . . 75.51 113.514 -172.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.0 m -39.48 114.89 0.45 Allowed 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 114.827 1.418 . . . . 55.21 114.827 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 14' ' ' ASP . 59.5 t -134.08 116.16 22.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 106.434 -1.691 . . . . 74.51 106.434 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.0 t -134.42 127.84 50.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.845 0 CA-C-O 120.611 0.243 . . . . 75.55 110.762 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -111.15 169.26 8.9 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.125 -0.694 . . . . 71.14 109.125 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.48 66.91 0.27 Allowed Glycine 0 C--N 1.303 -1.281 0 N-CA-C 111.001 -0.84 . . . . 74.44 111.001 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -139.63 136.18 34.06 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.578 -0.527 . . . . 61.02 109.578 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.6 t -175.74 153.0 1.34 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.139 -1.06 . . . . 71.41 108.139 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -104.95 82.96 1.93 Allowed 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.286 0.565 . . . . 63.24 109.969 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.6 m -100.59 57.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.364 0 CA-C-O 122.274 1.035 . . . . 62.14 111.456 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -170.8 147.9 2.83 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 106.299 -1.741 . . . . 72.41 106.299 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.4 166.63 14.69 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 71.45 110.283 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.516 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 64.45 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 32' ' ' ASP . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 72.14 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HB3' ' HA ' ' A' ' 29' ' ' GLU . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 34.35 110.187 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 55.14 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 40.52 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 54.34 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.497 HH22 HD23 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 65.32 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 60.35 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 64.0 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 65.31 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 64.21 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.667 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 42.13 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 63.11 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 44.22 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 72.42 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 70.34 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.452 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 73.42 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 60.23 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 74.32 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 72.13 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 72.03 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 54.42 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.674 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 42.01 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 54.25 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 32.01 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 65.2 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 42.53 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 72.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 64.24 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 63.5 t60 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 62.42 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.43 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 63.34 110.828 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 73.12 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.43 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 62.01 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.401 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 74.43 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.23 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 91' ' ' GLU . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 54.11 110.778 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 43.44 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 61.22 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 40.3 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 65.44 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 63.22 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.421 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 61.35 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 72.33 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.469 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 62.42 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 61.51 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 74.11 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 52.13 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 71.12 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 53.5 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.11 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 73.53 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 72.12 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.04 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.01 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 64.55 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 71.21 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 64.24 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 65.43 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.529 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 70.01 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 71.33 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 71.14 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.603 ' HA ' HG12 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 71.22 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 65.11 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.425 ' HB3' ' HB ' ' A' ' 139' ' ' THR . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 62.41 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.425 ' HB ' ' HB3' ' A' ' 135' ' ' SER . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 71.43 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.529 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 54.21 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 42.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.469 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 61.23 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.509 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 55.12 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 54.43 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.13 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.509 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 72.04 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.522 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 62.24 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 64.35 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.522 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 72.24 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 63.03 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLY . . . . . 0.516 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 43.35 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.452 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 52.42 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 43.31 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 74.4 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 53.23 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 71.31 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.473 HD22 HG22 ' A' ' 142' ' ' ILE . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 65.24 109.299 -175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 64.04 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.463 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 71.12 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 72.41 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 55.54 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 52.25 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 64.55 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.454 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 61.41 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.443 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 185' ' ' MET . . . . . 0.454 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 73.43 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 60.21 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.725 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 63.15 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.454 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 72.41 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.404 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 74.0 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.725 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 73.21 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 62.15 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 -71.58 -29.87 65.2 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 52.5 tp -71.05 -43.39 67.92 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 110.242 -0.281 . . . . 50.2 110.242 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -67.17 -40.55 86.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.269 0.557 . . . . 73.11 109.824 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 46.9 ttp -69.57 -31.69 70.02 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.739 -0.664 . . . . 72.2 110.224 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 16.2 tpt -72.84 -33.91 66.45 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 109.359 -0.608 . . . . 64.44 109.359 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' ALA . . . . . 0.465 ' HA ' ' HB ' ' A' ' 215' ' ' ILE . . . -63.3 -38.38 90.92 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 122.572 0.349 . . . . 63.44 110.564 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 45.5 mt-10 -69.26 -42.61 75.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.915 -0.584 . . . . 75.45 110.751 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -66.7 -46.29 76.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 64.3 111.144 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 149.93 89.99 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 110.106 -1.198 . . . . 62.41 110.106 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ILE . . . . . 0.465 ' HB ' ' HA ' ' A' ' 211' ' ' ALA . 7.6 tp -82.11 131.61 33.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 121.112 0.482 . . . . 75.2 109.79 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 46.1 m -84.69 102.52 13.03 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 115.828 -0.623 . . . . 50.45 110.771 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -75.75 98.92 1.21 Allowed Glycine 0 N--CA 1.43 -1.705 0 N-CA-C 109.05 -1.62 . . . . 74.33 109.05 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -77.95 101.59 6.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.172 0.51 . . . . 65.22 110.932 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -86.59 127.28 34.9 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.482 -0.933 . . . . 62.11 108.482 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -107.57 -113.11 3.7 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 119.923 -1.132 . . . . 75.55 112.359 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -168.87 -175.19 2.3 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 105.854 -1.906 . . . . 62.32 105.854 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -82.31 115.64 21.46 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 106.805 -1.554 . . . . 64.03 106.805 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.29 -1.998 0 CA-C-O 117.931 -1.033 . . . . 65.23 108.985 179.332 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.441 -0.906 0 N-CA-C 109.122 -0.695 . . . . 71.22 109.122 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -150.97 96.24 2.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 109.04 -0.726 . . . . 55.23 109.04 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.45 -179.92 30.94 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.235 -1.546 . . . . 63.43 109.235 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.8 tp -127.39 110.66 23.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 CA-C-O 121.577 0.703 . . . . 71.02 110.34 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.4 140.78 30.47 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.504 -0.771 . . . . 73.42 109.823 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.48 -36.46 0.09 OUTLIER Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 121.08 -0.581 . . . . 61.44 111.723 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -65.2 94.34 0.15 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.788 0.804 . . . . 70.41 111.716 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 m -108.64 5.17 24.68 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 122.886 1.327 . . . . 72.25 108.397 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -151.59 150.4 30.27 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 113.725 -1.58 . . . . 74.45 106.931 -175.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.49 153.72 29.39 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.63 -0.878 . . . . 73.23 108.63 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -83.73 -19.8 34.55 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 120.888 0.375 . . . . 64.33 111.074 -176.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 53.56 59.68 4.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 122.765 1.269 . . . . 74.01 111.619 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -144.36 179.81 7.01 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 105.605 -1.998 . . . . 71.21 105.605 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.27 -19.59 65.52 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.142 0.496 . . . . 73.5 110.165 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.2 m 73.82 103.8 0.07 Allowed 'General case' 0 C--O 1.243 0.755 0 C-N-CA 125.219 1.408 . . . . 73.22 111.88 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -93.2 105.86 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.884 -1.053 . . . . 74.41 110.634 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.0 t -96.92 106.61 18.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.863 0 N-CA-C 107.794 -1.188 . . . . 62.51 107.794 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.14 103.41 14.9 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.441 -1.318 . . . . 52.04 107.441 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.95 51.3 0.67 Allowed Glycine 0 N--CA 1.422 -2.29 0 N-CA-C 110.066 -1.214 . . . . 74.22 110.066 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.69 134.38 35.15 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.883 -0.414 . . . . 73.52 109.883 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -104.45 135.71 45.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.498 -0.927 . . . . 71.54 108.498 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.0 m -82.04 131.04 35.24 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.096 -0.705 . . . . 52.44 109.096 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.4 m -81.06 74.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-O 122.084 0.945 . . . . 73.02 113.331 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 178.35 161.98 0.65 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 105.796 -1.928 . . . . 75.41 105.796 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . -123.22 148.36 45.92 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.774 0.321 . . . . 64.23 110.755 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 71.24 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 71.34 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 70.25 111.128 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 61.3 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.484 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 71.32 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.31 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 71.54 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 64.45 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 64.43 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 62.25 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 53.01 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 74.34 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 64.43 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.743 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 52.42 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 73.53 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 64.52 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.647 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 64.31 110.769 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.32 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 65.32 110.623 -177.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.458 HG23 ' HB1' ' A' ' 64' ' ' ALA . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.35 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 71.14 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 73.14 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 90.0 m-20 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 64.14 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 72.34 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB1' HG23 ' A' ' 56' ' ' VAL . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 64.34 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 55.21 110.881 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 70.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.51 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.01 108.153 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 63.25 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.22 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 60.44 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 54.23 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 61.22 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 60.43 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.912 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 45.3 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 164' ' ' LEU . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 54.34 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 72.1 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 64.51 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 71.11 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 71.34 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.743 ' HG3' HG21 ' A' ' 47' ' ' THR . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 73.41 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 61.05 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.609 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 63.33 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 44.34 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 71.4 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 73.52 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.484 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 41.2 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 53.44 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 72.14 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 119' ' ' LEU . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 53.33 112.021 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 71.22 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 72.42 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 70.22 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.594 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.481 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 42.04 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.506 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.594 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 64.12 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 73.4 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 64.41 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.493 ' HA ' HG12 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 71.1 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 42.44 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.576 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 61.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 71.54 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 31.11 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.576 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 64.2 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 71.11 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 72.14 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 73.1 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 73.23 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.43 ' HB2' HG23 ' A' ' 142' ' ' ILE . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.12 109.057 -176.708 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.454 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.431 ' O ' HG22 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 71.51 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 73.35 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 74.2 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.626 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 62.44 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 74.24 110.763 -176.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.1 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 54.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.04 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 71.45 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.02 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.468 HD21 ' HB ' ' A' ' 126' ' ' ILE . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 73.24 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 63.25 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 73.04 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 63.52 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.501 ' HA ' HG22 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 64.43 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' VAL . . . . . 0.501 HG22 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 70.11 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.04 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 60.32 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.461 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.43 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.461 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 53.31 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 71.21 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 63.42 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 60.32 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 63.13 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 73.1 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 50.55 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 210' ' ' MET . 33.0 ttm180 -71.89 -34.56 69.26 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 50.8 tp -68.18 -43.6 77.78 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.307 -0.627 . . . . 71.23 109.307 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.78 -34.08 77.34 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 115.831 -0.622 . . . . 72.44 110.176 177.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 48.2 ttm -61.79 -46.67 88.55 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 123.806 0.842 . . . . 73.34 109.902 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 25.9 mmt -64.65 -37.34 87.25 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.77 -0.65 . . . . 63.53 110.834 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.66 -35.22 72.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 74.55 110.751 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -67.76 -45.62 74.38 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.4 1.08 . . . . 73.22 108.643 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -68.76 -35.65 77.35 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.175 -0.92 . . . . 74.53 109.77 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 89.85 24.48 29.94 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 110.512 -1.035 . . . . 72.23 110.512 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ILE . . . . . 0.405 ' O ' ' HB3' ' A' ' 210' ' ' MET . 47.4 mm -127.44 117.42 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 N-CA-C 108.605 -0.887 . . . . 73.42 108.605 -176.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.8 t -90.07 90.62 8.21 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.556 -0.905 . . . . 73.54 108.556 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -139.22 49.53 0.82 Allowed Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 110.871 -0.891 . . . . 74.4 110.871 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -95.63 102.88 14.72 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.594 -0.521 . . . . 71.21 109.594 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.78 107.18 18.53 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.216 0.532 . . . . 65.34 110.207 -179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -101.97 19.83 47.91 Favored Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.526 -1.029 . . . . 74.2 110.526 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -75.04 88.86 2.41 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.575 -0.898 . . . . 61.24 108.575 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.66 -58.75 3.55 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 114.373 -1.285 . . . . 52.14 108.857 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 106.202 -1.777 . . . . 71.52 106.202 177.746 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 107.32 -1.363 . . . . 74.42 107.32 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 p -80.53 156.41 26.52 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 109.023 -0.732 . . . . 73.13 109.023 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.41 159.29 28.35 Favored Glycine 0 N--CA 1.424 -2.126 0 C-N-CA 119.314 -1.422 . . . . 74.34 112.124 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 pt -88.35 97.16 6.49 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.192 0 CA-C-O 122.254 1.026 . . . . 74.54 108.882 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -97.63 109.96 22.62 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 114.677 -1.147 . . . . 64.4 108.672 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.46 142.63 25.06 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 110.148 -1.181 . . . . 63.25 110.148 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.62 121.69 30.37 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 109.526 -0.546 . . . . 64.43 109.526 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.9 t -88.84 106.62 18.5 Favored 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.267 1.032 . . . . 51.33 108.808 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -105.3 150.75 24.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.257 -0.883 . . . . 74.2 110.965 -175.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.672 ' OD2' ' HG3' ' A' ' 12' ' ' LYS . 9.5 t70 -153.13 144.07 22.91 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 115.452 -0.795 . . . . 63.33 109.956 -176.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -83.03 -58.23 2.95 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.984 0.735 . . . . 73.43 112.984 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.672 ' HG3' ' OD2' ' A' ' 10' ' ' ASP . 62.3 mttp 55.36 60.55 3.32 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.795 0.807 . . . . 73.23 111.338 -167.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -86.57 122.56 30.67 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 107.629 -1.248 . . . . 63.13 107.629 176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -95.06 -49.71 5.41 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.239 -0.437 . . . . 72.13 111.396 -175.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.4 m 59.49 81.71 0.16 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.027 0.918 . . . . 63.33 109.752 -175.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.14 113.52 35.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 CA-C-O 121.807 0.813 . . . . 71.0 112.82 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -96.08 129.51 46.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 107.965 -1.124 . . . . 74.32 107.965 174.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -82.29 130.46 35.1 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.234 -0.654 . . . . 72.02 109.234 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.52 47.53 1.03 Allowed Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 120.697 -0.763 . . . . 74.24 112.257 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.27 138.27 31.59 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.191 -0.67 . . . . 75.41 109.191 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.0 m -147.86 143.97 27.8 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.078 -1.082 . . . . 73.13 108.078 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 23.3 m -99.39 99.56 10.5 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.022 -0.732 . . . . 62.44 109.022 176.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -79.08 129.07 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 N-CA-C 109.331 -0.618 . . . . 61.43 109.331 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 70.13 170.02 0.31 Allowed 'General case' 0 N--CA 1.436 -1.135 0 CA-C-O 121.778 0.799 . . . . 73.51 110.814 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.34 164.28 13.28 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 115.425 -0.807 . . . . 72.24 109.212 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 70.11 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 71.31 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 72.31 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 32.3 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 70.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 64.34 108.945 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 52.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.607 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 71.31 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 65.12 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.566 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.634 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 61.43 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 64.33 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.35 109.897 -175.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 55.23 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 61.44 112.237 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 61.21 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 71.5 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.589 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 70.32 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 63.2 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 54.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 33.51 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 72.23 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.463 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.2 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 98' ' ' ASN . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.49 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 64.41 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 70.42 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 71.33 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 65.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.414 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 33.23 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 53.23 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 63.04 111.505 178.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.02 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 74.22 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.12 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 71.42 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.455 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 72.02 107.301 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 62.15 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 72.44 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.55 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 44.05 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.468 ' HA ' HD21 ' A' ' 72' ' ' LEU . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 63.1 111.418 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.634 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 35.31 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.499 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 40.25 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 63.41 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.51 ' O ' HG23 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 63.34 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.572 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 70.24 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 43.22 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.32 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 73.13 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 63.5 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 35.51 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 55.34 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 64.51 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.625 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 64.31 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 73.01 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.625 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 51.11 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 72.03 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' A' ' 129' ' ' TRP . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 64.52 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 61.41 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 53.13 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 73.11 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 52.21 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 71.31 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.512 HG23 ' HG2' ' A' ' 143' ' ' GLN . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.11 109.389 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HA ' HD12 ' A' ' 169' ' ' LEU . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 65.3 112.594 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 62.15 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.22 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.492 ' HB2' ' HH2' ' A' ' 129' ' ' TRP . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 62.43 109.727 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 72.15 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 73.44 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 73.12 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 41.51 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 55.14 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 45.2 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 64.2 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 55.34 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 55.14 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 170' ' ' GLU . . . . . 0.456 ' H ' HD13 ' A' ' 169' ' ' LEU . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.461 ' HB2' HG12 ' A' ' 167' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 62.24 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 63.14 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 62.14 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.449 ' O ' HD13 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 64.44 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.02 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.449 HD13 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 40.14 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.417 ' HA ' HD11 ' A' ' 186' ' ' ILE . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 60.21 111.136 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.53 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 64.55 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' MET . . . . . 0.567 ' HA ' HG22 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.22 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 51.14 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 185' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 65.42 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.572 ' SD ' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 53.04 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 64.32 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.33 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 64.24 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 53.15 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 74.44 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 60.2 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 62.11 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 53.41 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 71.31 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ARG . . . . . 0.569 ' O ' ' HG3' ' A' ' 210' ' ' MET . 98.3 mtt180 -78.26 -32.69 49.74 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 64.23 110.8 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.4 tp -65.01 -38.0 89.49 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.105 -0.702 . . . . 74.54 109.105 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.36 82.66 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.859 -0.61 . . . . 73.44 109.507 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.2 ttt -68.07 -35.02 77.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.65 -0.705 . . . . 75.45 110.228 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 206' ' ' ARG . 65.6 mtt -68.05 -38.17 82.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.056 -0.52 . . . . 64.11 109.753 176.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.86 75.86 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.75 -0.659 . . . . 64.32 110.223 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -59.14 -44.21 92.05 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.084 0.954 . . . . 61.13 108.708 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.36 -45.68 90.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.347 -0.842 . . . . 64.35 109.338 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 135.62 -71.5 0.48 Allowed Glycine 0 N--CA 1.433 -1.561 0 N-CA-C 108.694 -1.762 . . . . 70.41 108.694 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 13.2 tt -144.14 140.3 24.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.555 -0.905 . . . . 63.1 108.555 175.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 26.5 t -131.98 -41.2 1.03 Allowed 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.132 -0.692 . . . . 63.22 109.132 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 146.32 -85.68 0.17 Allowed Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 109.786 -1.326 . . . . 73.34 109.786 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' ALA . . . . . 0.466 ' HB2' ' SD ' ' A' ' 210' ' ' MET . . . 54.66 78.54 0.17 Allowed 'General case' 0 C--O 1.243 0.745 0 C-N-CA 124.717 1.207 . . . . 73.4 113.059 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -141.89 147.67 37.48 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.385 -0.968 . . . . 62.11 108.385 178.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 146.61 123.42 1.48 Allowed Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.099 -0.8 . . . . 42.25 111.099 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -127.53 140.8 51.89 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 122.714 0.406 . . . . 72.41 110.012 -177.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -93.07 114.57 27.15 Favored 'General case' 0 C--N 1.298 -1.661 0 N-CA-C 109.07 -0.715 . . . . 71.24 109.07 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 CA--C 1.483 -1.626 0 N-CA-C 107.503 -1.295 . . . . 70.22 107.503 174.381 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 121.157 0.504 . . . . 71.33 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.2 p -154.89 149.87 26.83 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.591 -1.263 . . . . 64.3 107.591 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.67 171.76 20.69 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.814 -1.184 . . . . 61.42 112.834 -176.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.0 mt -129.33 91.92 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 108.714 -0.847 . . . . 74.33 108.714 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.42 132.07 35.83 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.655 -1.609 . . . . 74.04 106.655 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -136.68 26.48 3.03 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.381 -0.914 . . . . 62.01 113.379 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.4 t -70.91 95.49 1.17 Allowed 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.274 0.559 . . . . 73.44 110.186 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -78.61 115.3 18.22 Favored 'General case' 0 N--CA 1.426 -1.638 0 N-CA-C 106.658 -1.608 . . . . 64.43 106.658 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.25 108.42 5.77 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.806 0.669 . . . . 51.3 112.806 -172.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -122.35 105.85 10.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.448 -1.686 . . . . 73.51 106.448 171.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -84.03 -17.32 40.78 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 116.036 -0.529 . . . . 73.33 112.032 -173.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? 71.54 144.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.076 1.35 . . . . 74.23 111.487 -177.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -113.18 88.43 2.83 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 107.775 -1.195 . . . . 73.32 107.775 170.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.23 -7.14 50.19 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 114.473 -1.239 . . . . 75.11 113.12 -173.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.7 t 66.42 79.35 0.24 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 122.388 1.09 . . . . 74.25 109.355 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 26.4 t -101.6 115.82 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.631 0 CA-C-N 114.483 -1.235 . . . . 63.55 107.738 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.61 83.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.05 0 CA-C-O 122.562 1.172 . . . . 63.02 109.341 177.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -108.51 95.0 5.36 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.774 -1.103 . . . . 74.4 109.104 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.79 51.43 0.19 Allowed Glycine 0 N--CA 1.419 -2.446 0 N-CA-C 110.744 -0.943 . . . . 74.14 110.744 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.8 78.93 9.63 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.452 -0.944 . . . . 73.45 108.452 177.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.5 t -98.85 174.62 6.29 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-N 114.218 -1.355 . . . . 74.42 109.101 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.6 m -72.91 95.12 1.92 Allowed 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.97 -0.559 . . . . 64.24 109.624 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -75.32 101.12 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 121.597 0.713 . . . . 73.24 111.325 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 65.74 91.25 0.08 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 113.754 -1.566 . . . . 71.13 109.832 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -84.11 176.04 9.08 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.614 -1.176 . . . . 73.51 111.053 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 53.3 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 82' ' ' LYS . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 64.43 110.459 176.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 65.13 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 71.5 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.48 HD21 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.13 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 70.11 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.676 HG21 ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 62.12 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 72.02 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.684 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 91.6 m-20 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 53.43 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 44.2 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.473 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 67' ' ' ILE . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 63.45 112.397 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 57' ' ' LYS . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 64.31 108.039 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 73.52 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 52.51 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 71.3 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.41 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 34.31 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.495 ' HB ' HG21 ' A' ' 56' ' ' VAL . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 63.01 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 71.24 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 72.24 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 73.12 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 38' ' ' TYR . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.619 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 53.21 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.504 ' OE1' ' HG3' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 63.55 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 62.21 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 72.31 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 73.0 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD13 HG23 ' A' ' 176' ' ' VAL . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.31 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HB3' HG23 ' A' ' 31' ' ' ILE . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.12 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.488 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 52.15 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 71.21 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 65.44 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 72.14 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 43.14 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 53.53 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.529 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.412 ' HA ' HD21 ' A' ' 72' ' ' LEU . 4.4 m-20 -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 60.0 111.26 -177.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.684 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 73.2 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 72.41 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 61.23 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 53.34 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 74.24 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 61.21 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 62.25 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 61.45 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.693 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 55.3 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.424 HG22 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 73.22 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 53.41 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 71.03 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.693 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 73.43 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.517 HD21 HG21 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.453 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 73.02 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.44 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 64.22 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.436 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 64.45 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.664 ' O ' HG12 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 130' ' ' LYS . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 72.51 107.694 171.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 61.54 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.0 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 61.2 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.575 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 72.12 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 61.54 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 41.12 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.502 HD13 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 64.01 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 64.41 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.46 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 72.02 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.4 ' HB2' HG23 ' A' ' 142' ' ' ILE . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 63.33 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HB2' HD13 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 64.41 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 70.1 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 72.41 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 72.45 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.14 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 65.32 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.406 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 62.21 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 70.41 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 20.23 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 73.13 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 64.14 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.419 ' HB3' HG23 ' A' ' 126' ' ' ILE . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 62.3 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 64.01 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.25 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.545 HG23 HD13 ' A' ' 81' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 52.51 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 61.33 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 72.34 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 53.44 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 53.01 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 71.04 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 45.21 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 60.31 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 43.12 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 54.2 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -64.24 -42.61 96.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 64.04 109.351 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.51 -42.89 91.54 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 108.886 -0.783 . . . . 74.25 108.886 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.5 86.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.022 0.439 . . . . 53.55 110.68 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 25.5 ttt -62.41 -45.28 93.83 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.627 -0.715 . . . . 74.54 109.774 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 66.1 mtt -67.12 -39.35 86.62 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.569 -0.742 . . . . 75.44 110.74 178.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.7 -27.77 64.24 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.64 0.607 . . . . 54.52 112.64 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -36.83 66.39 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.033 -1.099 . . . . 75.55 108.033 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -53.92 7.2 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.298 -1.001 . . . . 73.4 108.298 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -148.93 -95.45 0.15 Allowed Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.562 -1.015 . . . . 73.4 110.562 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 38.3 pt -144.05 166.76 12.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 108.469 -0.937 . . . . 72.31 108.469 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.4 t -100.75 88.6 3.63 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 106.798 -1.556 . . . . 72.21 106.798 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -103.41 129.02 9.72 Favored Glycine 0 N--CA 1.432 -1.58 0 C-N-CA 120.495 -0.859 . . . . 61.52 112.295 -176.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -116.91 -178.28 3.4 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.457 -0.571 . . . . 54.42 109.457 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -91.42 -50.74 5.64 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 110.161 -0.311 . . . . 60.44 110.161 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 72.08 35.58 60.95 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.98 -0.554 . . . . 70.33 112.677 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -80.44 -51.93 8.25 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.79 -0.241 . . . . 71.12 110.421 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 222' ' ' LYS . . . . . 0.407 ' HD3' ' HB2' ' A' ' 223' ' ' ASP . 13.1 tmtt? 77.63 136.63 0.06 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 124.938 1.399 . . . . 72.2 109.596 -174.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 223' ' ' ASP . . . . . 0.407 ' HB2' ' HD3' ' A' ' 222' ' ' LYS . 10.2 t70 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 125.619 1.567 . . . . 72.13 109.707 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.5 m . . . . . 0 C--O 1.244 0.779 0 CA-C-O 120.625 0.25 . . . . 61.11 111.448 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.4 p -163.3 117.51 1.62 Allowed 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.344 0.658 . . . . 74.2 109.315 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -126.17 176.01 17.58 Favored Glycine 0 N--CA 1.423 -2.2 0 C-N-CA 120.068 -1.063 . . . . 73.14 112.785 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mp -82.43 150.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 N-CA-C 108.318 -0.993 . . . . 65.41 108.318 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 7.2 mp0 -52.85 141.04 22.65 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.284 1.033 . . . . 75.5 110.179 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.21 126.42 8.25 Favored Glycine 0 N--CA 1.426 -2.031 0 N-CA-C 107.994 -2.043 . . . . 54.31 107.994 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 p -65.67 116.45 6.9 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 117.358 0.579 . . . . 54.43 111.009 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.2 m -81.97 77.83 8.74 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-O 121.899 0.857 . . . . 72.44 109.367 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -137.19 132.71 34.28 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-N 114.991 -1.004 . . . . 73.12 108.661 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.484 ' OD1' ' HG3' ' A' ' 12' ' ' LYS . 24.2 t0 -139.59 124.13 18.25 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.992 -0.744 . . . . 55.13 108.992 175.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -89.33 -13.17 38.52 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.414 -0.812 . . . . 64.31 110.993 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.484 ' HG3' ' OD1' ' A' ' 10' ' ' ASP . 50.0 mttp -55.34 119.74 6.04 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.009 0.433 . . . . 70.23 111.544 -176.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -124.46 128.3 48.8 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.156 -0.683 . . . . 74.34 109.156 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -109.42 -34.3 6.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 120.263 -0.575 . . . . 74.54 111.425 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.8 m 61.54 78.57 0.28 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.966 0.791 . . . . 71.2 111.538 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.4 t -73.05 101.84 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.205 -0.907 . . . . 72.52 110.664 -176.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -91.92 143.36 11.48 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 CA-C-N 115.031 -0.986 . . . . 75.11 109.489 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.268 0.0 OUTLIER -89.22 141.66 28.33 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.957 0.725 . . . . 51.14 112.957 178.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.3 -162.17 36.52 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 114.871 -1.059 . . . . 51.41 113.31 -175.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 72.9 86.36 0.11 Allowed 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.368 1.467 . . . . 70.54 109.944 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.2 p -115.52 111.4 20.67 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.758 -1.11 . . . . 62.23 110.609 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.6 m -145.57 83.08 1.65 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.0 -0.741 . . . . 70.33 109.0 176.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 19.3 t -96.72 57.98 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.735 0.779 . . . . 73.35 110.149 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 23' ' ' VAL . 25.9 tt0 165.32 161.05 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 104.698 -2.334 . . . . 73.43 104.698 176.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -146.02 152.72 39.81 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.518 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 65.23 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.22 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.518 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 54.42 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 73.54 108.977 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 71.03 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 65.13 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 63.31 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 64.54 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.733 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 42.14 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 73.45 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 74.14 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 43.1 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.532 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 61.41 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 62.12 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.431 ' HA ' HG22 ' A' ' 56' ' ' VAL . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 63.32 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' A' ' 53' ' ' ASP . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 71.54 110.276 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 62.0 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 60' ' ' LEU . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' LEU 0.262 4.7 m-20 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 63.03 113.274 -175.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 63.11 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.43 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 54.13 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.496 HD12 ' H ' ' A' ' 67' ' ' ILE . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 52.12 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.505 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 34.34 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 73.03 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 71.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.733 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 43.11 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.45 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.14 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.54 ' HE2' HD13 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.443 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 54.33 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 70.23 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.443 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 63.13 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 64.1 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 71.15 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 63.22 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.408 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 65.51 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 61.03 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 44.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 63.24 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 72.1 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 41.24 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 65.03 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.478 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 63.31 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 61.43 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 71.31 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 64.31 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 63.04 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 70.22 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.509 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 65.22 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 62.53 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.526 ' HB3' HD13 ' A' ' 27' ' ' LEU 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 119' ' ' LEU . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 71.45 110.862 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.669 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 73.31 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.04 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 60.13 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 65.54 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.516 ' HH2' ' HB2' ' A' ' 153' ' ' TRP 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 73.1 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 62.21 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HB3' ' HE3' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 41.41 109.46 175.374 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 54.11 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 64.42 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 74.1 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 54.31 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 63.33 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.474 HG21 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 62.24 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 72.55 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.44 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.442 HG21 HD21 ' A' ' 169' ' ' LEU . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 60.44 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.669 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 159' ' ' PHE . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 55.11 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.534 ' ND1' HD12 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 53.53 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.545 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 150' ' ' THR . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 71.43 110.084 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ALA . . . . . 0.412 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 173' ' ' ALA . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 61.12 111.278 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 72.33 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.13 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 177' ' ' ASN . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 61.43 111.735 -177.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 50.14 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.489 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.14 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 73.42 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 70.43 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' ASN . . . . . 0.554 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 63.34 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.25 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 71.04 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.416 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 50.31 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 45.11 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 63.41 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 71.11 110.409 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 40.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 63.31 110.434 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -70.23 -37.3 74.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 62.01 111.172 -177.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.73 -42.62 90.84 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.683 -0.488 . . . . 73.22 109.683 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -69.42 -35.36 75.65 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 116.184 -0.462 . . . . 60.44 110.338 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.1 ttt -65.43 -44.92 85.83 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.021 -0.536 . . . . 64.4 109.962 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 27.0 ttt -60.75 -43.32 98.09 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.967 -0.561 . . . . 72.51 110.044 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.65 84.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.793 -0.64 . . . . 63.55 111.152 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -74.4 -41.67 60.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.383 -0.371 . . . . 74.41 111.606 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -69.41 -53.44 19.36 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.849 -0.34 . . . . 74.14 110.412 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -179.98 103.19 0.17 Allowed Glycine 0 N--CA 1.422 -2.287 0 C-N-CA 120.068 -1.063 . . . . 32.32 111.365 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 7.0 tp -78.69 103.43 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.304 0 N-CA-C 108.27 -1.011 . . . . 71.44 108.27 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.9 t -147.97 164.23 34.4 Favored 'General case' 0 N--CA 1.42 -1.956 0 N-CA-C 107.95 -1.13 . . . . 73.32 107.95 -174.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 111.4 112.41 3.3 Favored Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 111.103 -0.799 . . . . 74.43 111.103 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -85.34 14.33 5.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.085 0.469 . . . . 65.51 111.401 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -93.68 162.47 13.93 Favored 'General case' 0 C--O 1.25 1.094 0 CA-C-O 121.441 0.639 . . . . 74.44 110.644 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -161.24 -175.17 31.97 Favored Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 107.429 -2.268 . . . . 53.45 107.429 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 221' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 221' ' ' LYS . 11.4 mmmt -114.31 95.8 5.46 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 122.014 0.911 . . . . 75.04 113.358 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -102.03 126.05 48.87 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 113.734 -1.575 . . . . 63.12 106.965 174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 . . . . . 0 C--O 1.244 0.811 0 O-C-N 124.304 1.003 . . . . 73.11 109.881 -178.538 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 120.801 0.334 . . . . 72.22 110.311 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 m -152.0 176.76 11.17 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.302 -0.999 . . . . 64.44 108.302 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 114.67 178.65 18.89 Favored Glycine 0 N--CA 1.437 -1.277 0 C-N-CA 120.782 -0.723 . . . . 63.55 111.455 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tt -136.56 131.87 48.13 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 CA-C-O 121.196 0.522 . . . . 55.22 110.865 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -123.68 74.65 1.28 Allowed 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 107.97 -1.122 . . . . 72.4 107.97 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.21 32.28 5.53 Favored Glycine 0 C--N 1.309 -0.965 0 CA-C-N 115.783 -0.644 . . . . 71.14 112.804 -175.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 p -94.53 105.97 17.94 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 121.127 0.489 . . . . 71.51 110.427 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.4 t -144.02 88.6 1.97 Allowed 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 107.528 -1.286 . . . . 72.34 107.528 175.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -135.15 131.15 36.46 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.281 -0.872 . . . . 73.41 110.376 -172.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -94.29 161.16 14.36 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.665 -0.698 . . . . 64.5 109.716 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.91 -59.67 2.6 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.827 -0.805 . . . . 74.04 108.827 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.6 mttp 179.5 170.05 1.06 Allowed 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 127.868 2.467 . . . . 74.52 104.413 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -110.76 81.12 1.38 Allowed 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 107.287 -1.375 . . . . 71.41 107.287 167.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.02 -41.87 97.3 Favored 'General case' 0 CA--C 1.481 -1.706 0 CA-C-N 114.292 -1.322 . . . . 65.34 111.208 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 55.86 87.68 0.05 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 124.905 1.378 . . . . 63.23 110.907 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -79.87 91.3 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.774 -0.825 . . . . 73.2 108.774 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.25 121.01 41.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.723 0.773 . . . . 62.22 111.403 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -115.01 105.22 12.71 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.31 -0.996 . . . . 73.21 108.31 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.56 104.28 1.34 Allowed Glycine 0 N--CA 1.439 -1.15 0 O-C-N 123.514 0.509 . . . . 52.33 112.199 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.44 115.7 21.58 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.422 -0.585 . . . . 73.44 109.422 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.9 m -156.28 129.7 8.2 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.276 -1.379 . . . . 53.33 107.276 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.8 m -77.88 81.42 4.29 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.256 0.55 . . . . 54.12 111.708 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.42 HG12 ' OE2' ' A' ' 24' ' ' GLU . 13.1 t -102.31 121.24 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 106.097 -1.816 . . . . 52.4 106.097 177.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' HG12 ' A' ' 23' ' ' VAL . 1.7 mp0 76.16 111.58 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.805 1.242 . . . . 51.12 110.267 -171.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.62 175.99 6.62 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.9 -0.591 . . . . 62.32 109.876 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.506 HD13 ' HB3' ' A' ' 118' ' ' GLU . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 70.24 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 53.04 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 53.24 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.03 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 62.31 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 52.34 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 63.44 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 55.42 108.562 173.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 64.3 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 72.11 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 54.35 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.31 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.637 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 74.42 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CE2' HG22 ' A' ' 47' ' ' THR . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 71.52 109.882 175.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.21 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HA ' HG22 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 62.23 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 60.01 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 72.3 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.498 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 52.22 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 73.2 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.04 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 65.12 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 72.34 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 41.41 111.464 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.498 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 65.41 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 62.41 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 70.21 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 61.32 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 72.35 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 60.21 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 63.34 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 61.35 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 72.41 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 91' ' ' GLU . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 74.14 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 62.42 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 53.44 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.22 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 53.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.01 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 61.51 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.637 ' HG3' HG21 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 72.05 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.521 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.462 ' O ' HG23 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.05 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.702 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 54.11 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 65.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 60.01 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 64.43 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 73.21 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.506 ' HB3' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 55.22 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.482 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.45 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 54.33 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 71.14 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 72.13 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.553 HG23 HD12 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 72.1 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.618 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 52.14 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 71.43 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 43.4 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 54.44 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 53.14 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.458 HD12 ' HB2' ' A' ' 129' ' ' TRP . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 71.05 109.573 177.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.639 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 72.32 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 61.5 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.495 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 71.14 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 61.41 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 53.03 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 61.44 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 64.25 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 160' ' ' LYS . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 61.15 107.905 -178.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 62.4 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 63.12 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 72.11 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 60.02 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 63.34 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.529 ' H ' HG22 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 52.23 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 72.43 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.53 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 70.4 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 51.04 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 45.1 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 63.31 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 61.1 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 44.34 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 63.15 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 188' ' ' ILE . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 62.24 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 184' ' ' ASP . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 62.11 110.038 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 60.21 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 72.1 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 54.21 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.702 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 72.1 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 60.15 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 64.55 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 72.02 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 64.33 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 62.41 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 70.55 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 62.31 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.73 -45.19 62.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.33 -39.67 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.393 -0.367 . . . . 62.24 111.407 -178.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -68.63 -37.45 79.73 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.355 -0.384 . . . . 54.44 111.299 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.1 ttt -72.98 -41.53 64.26 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.158 -0.473 . . . . 54.3 110.662 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 213' ' ' GLN . 3.7 ppp? -73.66 -30.89 63.18 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 120.306 -0.558 . . . . 71.13 111.458 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 211' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' A' ' 215' ' ' ILE . . . -74.06 -33.84 63.84 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-O 121.116 0.484 . . . . 75.32 109.704 177.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -66.83 -41.05 88.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.784 -0.644 . . . . 65.25 110.977 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 213' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' ' 210' ' ' MET . 5.4 pp0? -67.92 -14.44 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.466 0.543 . . . . 75.05 112.466 -177.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 165.52 -88.09 0.1 Allowed Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 119.42 -1.371 . . . . 64.53 113.45 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 215' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 211' ' ' ALA . 42.1 pt -90.53 159.38 2.83 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 112.377 0.51 . . . . 71.02 112.377 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 8.2 p -98.57 134.94 40.82 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.563 -1.273 . . . . 74.44 107.563 174.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -133.67 103.43 0.5 Allowed Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 119.616 -1.278 . . . . 43.1 114.138 -173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -150.37 99.39 2.77 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.505 -1.665 . . . . 63.13 106.505 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -79.93 129.34 34.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.079 0.77 . . . . 62.51 113.079 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -88.23 124.32 7.13 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 114.716 -1.129 . . . . 52.03 110.827 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -135.59 168.94 18.32 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.264 -1.013 . . . . 60.35 108.264 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 222' ' ' LYS . . . . . 0.442 ' HE2' ' OD1' ' A' ' 223' ' ' ASP . 18.1 ptmt -95.07 -31.93 13.35 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.827 0.346 . . . . 60.44 110.107 176.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 223' ' ' ASP . . . . . 0.442 ' OD1' ' HE2' ' A' ' 222' ' ' LYS . 6.9 p-10 . . . . . 0 CA--C 1.502 -0.872 0 N-CA-C 108.335 -0.987 . . . . 63.34 108.335 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.798 -0.816 . . . . 73.35 108.798 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.8 m -77.99 151.8 33.41 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 116.278 -0.419 . . . . 71.22 109.985 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.33 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.998 -0.841 . . . . 64.23 110.998 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -104.49 104.53 16.98 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.196 -1.038 . . . . 75.22 108.196 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -99.97 115.76 30.45 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 115.904 -0.589 . . . . 61.5 109.909 -178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -140.72 54.51 0.64 Allowed Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 110.386 -1.085 . . . . 60.03 110.386 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 p -93.74 86.91 5.27 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.849 0.833 . . . . 72.42 110.525 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -97.17 102.57 14.38 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.054 -1.091 . . . . 44.33 108.054 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -85.78 77.98 9.64 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.502 1.144 . . . . 61.15 111.898 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -137.61 99.99 4.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 104.931 -2.248 . . . . 62.1 104.931 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -46.99 -52.67 14.17 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.411 1.634 . . . . 71.21 115.411 -170.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.7 mptt 70.28 80.7 0.17 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.506 0.67 . . . . 72.22 111.001 -169.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -138.28 122.77 18.43 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.381 -0.97 . . . . 73.33 108.381 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.62 -57.34 3.94 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.947 -0.57 . . . . 72.31 111.328 -173.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m 38.16 68.53 0.31 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.465 1.506 . . . . 73.52 114.67 177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.3 t -100.52 114.76 40.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 108.846 -0.798 . . . . 74.33 108.846 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -90.5 145.73 7.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 109.409 -0.589 . . . . 73.11 109.409 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -145.0 148.3 33.59 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.637 -0.875 . . . . 75.41 108.637 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.9 56.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.927 0 N-CA-C 109.457 -1.457 . . . . 41.22 109.457 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 123.35 27.35 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.134 -0.533 . . . . 61.22 112.008 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.0 t -173.49 132.39 0.47 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.19 -1.041 . . . . 63.24 108.19 176.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.6 m -85.29 107.22 17.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 109.25 -0.648 . . . . 71.4 109.25 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.74 99.66 2.21 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-O 120.99 0.424 . . . . 75.14 110.811 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 67.7 160.26 0.16 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.349 1.459 . . . . 43.45 113.1 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -98.93 173.84 6.65 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 114.93 -1.032 . . . . 74.24 111.643 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 33.13 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 62.01 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HE2' ' SG ' ' A' ' 86' ' ' CYS . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 73.33 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 60.32 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 82' ' ' LYS . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 70.44 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 72.21 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 70.3 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 73.42 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 73.44 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 73.22 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 61.12 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.757 HG21 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.24 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.33 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 73.43 113.849 176.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 71.42 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.499 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 85.0 m-20 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 55.12 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 50.13 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 65.21 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 64' ' ' ALA . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 53.34 112.482 -173.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 45.44 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 62.12 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.428 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 43.13 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 64.45 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 70.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 43.15 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 55.24 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 52.22 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.418 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HZ1' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 70.3 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 62.1 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 45.14 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 45.23 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 71.05 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 50.1 110.449 -176.124 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 64.54 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 60.12 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 72.12 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 61.12 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 61.42 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 64.04 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 52.22 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 54.01 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 72.53 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.602 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.401 ' HG ' ' HG3' ' A' ' 192' ' ' MET . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 71.1 111.631 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 60.04 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 64.14 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 70.42 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.487 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 63.13 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 63.03 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 71.35 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 63.45 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 43.12 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.484 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 63.31 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.428 ' O ' HG23 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 70.14 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.473 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 63.22 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 62.23 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.21 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 62.43 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 65.34 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 65.01 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.467 HD12 HD22 ' A' ' 172' ' ' LEU . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 62.14 111.495 -176.251 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.612 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 64.05 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 70.54 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 65.34 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.614 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 73.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 62.4 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.12 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 43.34 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.481 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.619 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 70.35 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.619 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 73.32 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.01 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.14 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' LEU . . . . . 0.467 HD22 HD12 ' A' ' 145' ' ' ILE . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 72.25 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.01 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 172' ' ' LEU . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 65.25 110.906 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 63.43 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 63.43 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.21 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 52.4 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 61.43 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.453 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 71.35 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 73.45 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 52.4 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 63.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.401 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 53.35 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 54.35 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 61.05 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 199' ' ' TRP . . . . . 0.45 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 64.22 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 72.44 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 71.41 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 50.14 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 65.15 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.91 -42.83 84.77 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 73.45 110.104 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 54.8 tp -69.76 -39.21 76.83 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.835 -0.431 . . . . 63.14 109.835 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.31 -43.47 94.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.447 0.641 . . . . 64.34 109.994 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 44.6 ttm -63.69 -41.46 98.13 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.372 -0.831 . . . . 61.51 110.015 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 43.5 ttm -64.9 -44.19 90.39 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.194 -0.912 . . . . 72.02 109.987 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -65.62 -40.98 93.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.614 -0.721 . . . . 74.31 110.654 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.21 -24.54 64.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.644 0.735 . . . . 73.25 110.494 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -88.81 -8.06 55.04 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 115.409 -0.814 . . . . 75.25 110.084 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 74.93 33.76 54.39 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 116.009 -0.541 . . . . 74.42 111.871 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 215' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' ' 210' ' ' MET . 49.7 mm -120.86 151.89 23.91 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 107.353 -1.351 . . . . 64.4 107.353 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.3 m -152.56 122.95 7.21 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.898 -0.408 . . . . 74.22 109.898 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 125.86 88.24 0.7 Allowed Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 119.741 -1.219 . . . . 73.04 114.597 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -129.92 91.66 3.17 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.497 -1.297 . . . . 51.22 107.497 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -79.49 129.92 34.92 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.586 0.708 . . . . 72.31 112.424 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -162.23 176.12 38.64 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 105.998 -2.841 . . . . 70.34 105.998 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -110.51 93.13 4.33 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 119.323 1.562 . . . . 65.44 109.982 177.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -113.33 7.41 17.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.321 -1.309 . . . . 73.34 108.278 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 105.767 -1.938 . . . . 74.03 105.767 -179.091 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.447 -0.605 0 N-CA-C 110.36 -0.237 . . . . 74.43 110.36 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 m 63.74 -174.5 0.16 Allowed 'General case' 0 C--O 1.249 1.052 0 C-N-CA 123.889 0.876 . . . . 65.3 112.878 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.8 176.49 48.05 Favored Glycine 0 N--CA 1.425 -2.044 0 N-CA-C 107.227 -2.349 . . . . 73.55 107.227 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.79 90.71 2.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 CA-C-N 118.147 0.973 . . . . 65.0 110.529 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -98.3 85.67 3.48 Favored 'General case' 0 N--CA 1.417 -2.113 0 N-CA-C 108.381 -0.97 . . . . 74.43 108.381 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.43 28.67 10.4 Favored Glycine 0 C--N 1.309 -0.961 0 N-CA-C 111.119 -0.792 . . . . 45.41 111.119 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 p -95.59 118.73 32.83 Favored 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 123.274 0.63 . . . . 62.4 110.003 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.6 t -156.19 127.62 7.16 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.181 0.515 . . . . 74.51 110.348 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -157.89 96.66 1.5 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.035 -1.469 . . . . 65.32 107.035 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.06 145.68 41.22 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.645 0.609 . . . . 75.55 112.645 -177.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -60.7 -29.38 69.3 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.605 1.162 . . . . 63.41 111.842 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 61.16 67.67 0.78 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.085 0.954 . . . . 74.22 109.754 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -89.16 92.03 9.03 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.935 0.874 . . . . 73.31 112.309 -176.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.5 -31.04 24.7 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.54 -0.911 . . . . 73.14 108.54 175.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.9 m 56.75 98.76 0.02 OUTLIER 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.206 1.403 . . . . 73.12 113.852 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.17 98.64 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.956 0 CA-C-O 122.378 1.085 . . . . 71.41 110.959 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.7 p -83.55 110.9 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 114.552 -1.204 . . . . 64.4 110.608 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.88 104.85 7.84 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.302 -0.999 . . . . 74.55 108.302 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.35 91.2 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 CA-C-N 115.733 -0.667 . . . . 74.21 112.482 -177.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.72 119.05 9.56 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.19 -1.041 . . . . 75.33 108.19 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -139.91 111.81 7.46 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 120.66 -0.416 . . . . 53.54 109.931 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.9 m -88.76 111.23 21.75 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 108.366 -0.975 . . . . 70.1 108.366 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.2 m -81.33 99.94 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 CA-C-O 121.691 0.758 . . . . 72.43 109.861 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 69.82 169.01 0.3 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 113.925 -1.489 . . . . 73.53 110.731 -173.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.79 178.31 6.08 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 115.058 -0.974 . . . . 65.54 108.71 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 64.25 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 71.53 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.03 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 38.1 tp60 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.432 HG23 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 74.52 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.47 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 41.35 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 71.23 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 55.21 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 33.03 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 61.21 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 73.32 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.21 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.578 HG21 ' HG3' ' A' ' 99' ' ' ARG . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 54.01 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 63.41 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 62.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.527 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.12 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 65.41 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.447 HG11 HG12 ' A' ' 67' ' ' ILE . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 74.41 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 71.41 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 4.3 m-20 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 74.03 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 52.21 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.447 HG12 HG11 ' A' ' 56' ' ' VAL . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 60.35 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 73.5 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 53.31 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 71.34 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 65.11 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 62.21 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 71.44 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.432 ' CZ ' HG23 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 75.5 t60 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.427 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 70.13 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 61.0 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.22 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 44.22 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.03 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.573 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 71.23 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 43.14 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.578 ' HG3' HG21 ' A' ' 47' ' ' THR . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 62.22 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 74.24 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 61.24 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 52.25 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 54.11 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 62.22 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.567 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 62.14 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 70.11 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' SER . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 61.21 110.045 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 73.43 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.12 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.467 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 42.1 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 73.33 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.423 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 61.12 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 61.24 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.459 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 64.44 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 73.22 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.582 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 65.12 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.582 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 71.44 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 53.14 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 71.34 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 51.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 53.25 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 62.23 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.447 HG22 ' HG ' ' A' ' 169' ' ' LEU . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.25 108.169 -177.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.514 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.557 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 63.12 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.402 ' HD2' ' CG ' ' A' ' 166' ' ' ASP . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 71.41 111.362 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.431 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 62.34 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 72.22 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 64.25 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.623 ' ND1' HD12 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 63.32 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 63.43 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 64.22 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.573 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ASP . . . . . 0.557 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 142' ' ' ILE . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 63.13 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 64.11 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 72.1 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 43.13 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.454 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 63.44 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.444 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 60.52 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.444 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 70.1 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.48 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 190' ' ' ASP . . . . . 0.554 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 43.3 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 64.11 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 63.45 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.24 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 198' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 64.53 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 199' ' ' TRP . . . . . 0.464 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 65.25 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 200' ' ' THR . . . . . 0.41 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 204' ' ' SER . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 73.13 108.762 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 203' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 201' ' ' LYS . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -72.44 -38.94 68.17 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 44.1 111.754 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.55 -33.96 41.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 119.682 -0.807 . . . . 72.31 110.476 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -66.17 -44.66 83.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.113 -0.494 . . . . 72.14 110.306 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 209' ' ' MET . . . . . 0.535 ' O ' ' HG2' ' A' ' 213' ' ' GLN . 53.0 ttm -63.71 -40.66 97.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.52 -0.472 . . . . 53.14 110.07 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.2 ttt -65.58 -38.84 90.67 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-N 116.105 -0.498 . . . . 70.4 110.873 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.94 -34.69 77.07 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.833 0.349 . . . . 71.45 111.163 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 43.9 mt-10 -76.7 -50.16 14.33 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.732 0.641 . . . . 74.44 112.732 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 209' ' ' MET . 19.6 pt20 -104.25 17.56 23.88 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.41 0.624 . . . . 64.34 112.611 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -146.28 -123.44 1.51 Allowed Glycine 0 N--CA 1.428 -1.874 0 N-CA-C 110.319 -1.112 . . . . 61.21 110.319 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 40.4 pt -119.94 158.33 21.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-O 120.934 0.397 . . . . 71.43 110.309 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.5 m -100.21 123.62 44.67 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 108.395 -0.965 . . . . 61.1 108.395 177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -80.99 97.77 1.79 Allowed Glycine 0 N--CA 1.439 -1.126 0 N-CA-C 111.235 -0.746 . . . . 70.35 111.235 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -132.83 98.35 4.29 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 120.704 0.288 . . . . 62.53 110.819 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 178.19 144.12 0.11 Allowed 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 125.225 1.41 . . . . 71.43 107.984 174.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -142.75 -142.99 4.1 Favored Glycine 0 N--CA 1.412 -2.962 0 N-CA-C 110.891 -0.884 . . . . 52.44 110.891 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.95 -60.67 0.23 Allowed 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 108.889 -0.782 . . . . 65.04 108.889 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.0 tttp 72.35 128.31 0.03 OUTLIER 'General case' 0 C--O 1.247 0.972 0 O-C-N 124.508 1.13 . . . . 65.0 111.583 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--N 1.29 -2.008 0 N-CA-C 105.077 -2.194 . . . . 63.33 105.077 173.558 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.727 0 CA-C-O 120.427 0.156 . . . . 70.42 111.079 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -160.85 151.58 18.4 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.18 -1.044 . . . . 72.5 108.18 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.03 -171.47 35.03 Favored Glycine 0 N--CA 1.429 -1.771 0 N-CA-C 109.82 -1.312 . . . . 73.53 109.82 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 67.8 mt -79.4 124.8 38.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 108.212 -1.033 . . . . 62.33 108.212 178.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.33 101.58 10.66 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.769 0.795 . . . . 71.24 110.055 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.42 17.04 59.69 Favored Glycine 0 C--N 1.314 -0.652 0 CA-C-N 115.293 -0.867 . . . . 61.34 111.609 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.9 p -83.79 102.87 12.63 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 123.233 0.613 . . . . 43.44 109.54 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.8 t -144.86 25.21 1.46 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.893 0.854 . . . . 73.44 109.71 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -78.45 132.51 37.32 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.051 -0.977 . . . . 73.42 109.155 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.53 135.07 48.27 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.991 -0.55 . . . . 61.15 110.224 -177.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.54 -33.26 42.04 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.899 -0.591 . . . . 74.25 111.641 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 2.2 mptp? -67.34 144.7 55.71 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 71.13 113.152 -166.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -96.76 174.11 6.97 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.086 -0.961 . . . . 73.31 109.62 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -73.05 -56.44 5.12 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.89 -0.595 . . . . 72.44 111.307 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.5 m -145.58 108.66 4.57 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.379 0.609 . . . . 73.43 110.307 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.5 t -84.45 86.69 2.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.62 -0.718 . . . . 63.41 109.34 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.0 t -126.55 97.42 4.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 N-CA-C 107.784 -1.191 . . . . 55.22 107.784 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -104.83 96.65 6.7 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 109.643 -0.503 . . . . 64.54 109.643 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.75 91.57 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.539 0 C-N-CA 120.188 -1.006 . . . . 71.05 111.697 -178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.36 169.26 9.47 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.835 -0.802 . . . . 64.03 108.835 177.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 m -98.21 106.02 18.25 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 109.489 -0.559 . . . . 74.22 109.489 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.4 p -84.52 99.04 10.46 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.246 0.546 . . . . 61.45 110.863 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.2 t -86.95 137.45 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 108.103 -1.073 . . . . 55.51 108.103 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 69.36 101.54 0.06 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.733 1.213 . . . . 73.33 110.477 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.88 176.28 7.98 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.162 -0.926 . . . . 55.04 110.903 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 64.1 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.576 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 64.34 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 71.34 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.504 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 62.41 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 50.35 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 65.14 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 63.01 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 71.01 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 55.34 110.372 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 64.15 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 63.24 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 55.0 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 74.45 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.13 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.594 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 54.55 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 45.02 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 73.23 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 63.44 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 72.14 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.42 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 71.41 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 54.44 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 42.54 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.511 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.11 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 71.1 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 62.22 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 55.52 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.31 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 64.22 109.087 169.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.695 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 60.12 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 55.05 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 54.33 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 71.24 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 72.11 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 53.04 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 64.1 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 52.34 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 61.14 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 74.31 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 65.11 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 63.24 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 54.2 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.454 ' O ' ' HA ' ' A' ' 39' ' ' SER . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 53.43 106.881 176.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 63.42 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.3 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.716 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 64.13 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 51.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.21 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.45 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 51.21 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 52.32 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 40.14 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 180' ' ' VAL . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 63.03 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.603 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 71.31 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 71.42 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 54.34 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.603 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 72.11 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.12 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 64.51 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.14 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.43 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.421 ' HA ' HG12 ' A' ' 141' ' ' VAL . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 63.22 109.435 -172.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 70.44 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 60.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 42.14 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 65.15 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 133' ' ' LYS . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 72.32 108.042 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 64.14 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 52.04 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASN . . . . . 0.533 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 64.12 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.405 ' O ' ' HB ' ' A' ' 150' ' ' THR . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 64.12 110.322 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 54.42 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 74.31 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.439 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 72.15 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 64.12 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.403 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.47 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 71.42 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 54.03 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 63.34 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.955 ' HD1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 70.4 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.955 ' HE1' ' HD1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 72.51 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ASP . . . . . 0.533 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.403 ' H ' HD12 ' A' ' 145' ' ' ILE . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 62.51 107.918 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 126' ' ' ILE . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 61.51 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 52.42 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 60.21 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' VAL . . . . . 0.564 ' HA ' ' HE2' ' A' ' 116' ' ' HIS . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 44.32 111.222 -179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 72.32 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 54.33 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 189' ' ' ASN . . . . . 0.418 ' N ' HD12 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.23 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 41.35 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.488 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 34.21 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 193' ' ' LYS . . . . . 0.629 ' HA ' HG22 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 74.33 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.42 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 71.11 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 61.45 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 54.12 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 62.02 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -67.12 -41.43 86.19 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.58 -28.81 67.27 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.892 0.377 . . . . 75.01 110.515 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 212' ' ' GLU . . . -70.35 -42.65 71.56 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.907 -0.775 . . . . 51.33 108.907 175.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 53.6 ttm -65.73 -33.75 76.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.433 0.635 . . . . 62.2 110.343 176.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 85.7 mtp -68.8 -29.53 67.91 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.669 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 211' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 214' ' ' GLY . . . -75.75 -24.56 56.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.457 0.646 . . . . 32.03 110.014 174.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 212' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 208' ' ' ALA . 16.9 mm-40 -70.57 -37.98 74.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.393 -0.965 . . . . 54.35 108.393 173.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.26 -48.68 69.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.109 -0.95 . . . . 72.11 108.553 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 211' ' ' ALA . . . 168.54 -91.01 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.384 0 N-CA-C 108.766 -1.734 . . . . 35.15 108.766 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 20.5 pt -140.39 -39.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 108.155 -1.054 . . . . 73.41 108.155 171.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 22.8 t 69.15 155.11 0.12 Allowed 'General case' 0 C--O 1.25 1.103 0 C-N-CA 124.891 1.276 . . . . 72.41 111.948 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -115.45 67.46 0.28 Allowed Glycine 0 N--CA 1.422 -2.279 0 N-CA-C 110.092 -1.203 . . . . 72.24 110.092 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -148.52 108.97 4.15 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.263 -0.643 . . . . 65.33 109.263 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.94 150.6 49.27 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.966 -0.753 . . . . 65.34 108.966 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -112.34 84.19 0.35 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.408 -0.901 . . . . 74.55 112.692 -177.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -149.59 145.86 27.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.468 -0.938 . . . . 70.01 108.468 176.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 222' ' ' LYS . . . . . 0.462 ' HG2' ' OD1' ' A' ' 223' ' ' ASP . 57.6 tttm -122.04 -73.66 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 120.64 -0.424 . . . . 70.42 111.798 -176.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 223' ' ' ASP . . . . . 0.462 ' OD1' ' HG2' ' A' ' 222' ' ' LYS . 5.4 p-10 . . . . . 0 CA--C 1.481 -1.683 0 N-CA-C 103.753 -2.684 . . . . 43.01 103.753 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.434 -1.246 0 N-CA-C 108.791 -0.818 . . . . 63.34 108.791 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 t -92.68 120.54 33.19 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.676 -1.231 . . . . 72.32 107.676 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.41 -176.72 34.34 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.737 -0.744 . . . . 44.43 111.741 -176.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.4 pt -99.56 101.34 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-O 122.079 0.942 . . . . 74.33 110.619 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -121.63 137.87 54.57 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 114.731 -1.122 . . . . 73.22 108.381 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -149.1 66.68 0.38 Allowed Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.052 -0.819 . . . . 44.12 111.052 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.8 t -93.26 107.74 19.5 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.793 -0.817 . . . . 60.14 108.793 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.4 m -139.77 106.63 5.4 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 109.235 -0.654 . . . . 71.41 109.235 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -80.37 96.4 6.67 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.957 -0.565 . . . . 73.34 110.274 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.31 109.81 21.09 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 106.618 -1.623 . . . . 64.02 106.618 176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.79 -29.1 70.34 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 115.059 1.503 . . . . 71.01 115.059 -168.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mptt 61.64 75.59 0.4 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.034 0.445 . . . . 55.14 110.961 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.471 ' H ' ' HD2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -86.43 129.13 34.97 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.284 -1.376 . . . . 73.32 107.284 174.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -84.16 -56.87 3.43 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 109.36 -0.607 . . . . 73.45 109.36 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.8 m 46.16 84.37 0.03 OUTLIER 'General case' 0 C--O 1.241 0.626 0 N-CA-C 114.82 1.415 . . . . 72.52 114.82 177.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 91.8 t -86.2 99.96 8.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.797 -1.186 . . . . 74.11 107.797 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -78.05 97.77 2.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 122.062 0.934 . . . . 72.11 109.156 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -129.99 152.55 49.33 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 106.894 -1.521 . . . . 74.35 106.894 -176.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.1 70.71 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 118.999 -1.572 . . . . 62.12 113.194 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -158.12 136.68 11.14 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.229 -1.026 . . . . 35.13 108.229 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.3 p -99.16 157.66 16.22 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.412 -0.588 . . . . 72.1 109.412 178.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.7 m -74.48 99.56 3.6 Favored 'General case' 0 N--CA 1.428 -1.536 0 N-CA-C 108.114 -1.069 . . . . 43.22 108.114 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -91.15 22.33 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.342 1.068 . . . . 63.53 111.857 -174.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -141.06 138.96 33.97 Favored 'General case' 0 C--N 1.255 -3.511 0 CA-C-N 112.309 -2.223 . . . . 75.42 107.814 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . -100.0 171.62 7.72 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.647 -0.706 . . . . 55.14 109.447 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' A' ' 157' ' ' HIS . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.228 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.421 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 63.21 111.518 -174.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 53.53 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.509 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 71.43 111.089 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.505 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 64.24 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.11 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 71.12 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 73.55 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 24.13 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 43.12 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 52.23 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.556 HG22 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 54.42 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 43.23 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.556 ' CZ2' HG22 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 61.44 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 102' ' ' PRO . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 71.25 107.688 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.45 ' HA ' HG22 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.554 ' O ' HD13 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.45 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 62.31 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 64.44 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 62.53 113.788 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.42 ' O ' HG22 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 60' ' ' LEU . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.13 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 HD21 ' A' ' 109' ' ' LEU . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.456 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.498 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 71.3 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.548 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.0 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.465 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.04 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 63.5 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 54.12 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 65.34 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 81' ' ' LEU . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 71.23 112.699 178.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 73.31 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 81' ' ' LEU . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 74.2 110.288 175.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.442 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 72.15 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 65.25 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 65.3 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 62.23 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 55.41 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 71.42 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 53.5 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.548 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.476 ' HA ' HD21 ' A' ' 72' ' ' LEU . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.537 ' HG3' HG21 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 72.52 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 72.0 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.463 ' HA ' HG23 ' A' ' 52' ' ' THR . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 71.12 114.883 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.454 ' C ' ' HB3' ' A' ' 223' ' ' ASP . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 45.03 112.019 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 72.11 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.458 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 73.2 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 71.24 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 70.32 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 62.42 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 73.01 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 70.45 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . 0.406 ' HB3' HG21 ' A' ' 180' ' ' VAL . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.02 111.423 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 55.55 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 71.31 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 73.24 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.03 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.535 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.535 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 127' ' ' ASP . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 73.4 109.353 171.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 131' ' ' LYS . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 74.15 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.62 ' HA ' HG12 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 61.42 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.549 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 74.42 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 45.22 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.483 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.409 ' HA ' HD22 ' A' ' 169' ' ' LEU . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.449 HG22 ' H ' ' A' ' 167' ' ' VAL . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 31.31 110.244 177.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 71.3 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.487 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 41.42 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 65.55 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ASN . . . . . 0.445 ' O ' HG22 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.42 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' TRP . . . . . 0.477 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 64.12 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 50.12 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.404 ' O ' ' HB3' ' A' ' 26' ' ' SER . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 45.12 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.23 111.42 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . 0.538 ' HB3' ' HG2' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 73.41 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ASN . . . . . 0.451 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.449 ' H ' HG22 ' A' ' 145' ' ' ILE . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 71.13 107.535 -176.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 72.2 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 72.32 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 44.4 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 62.12 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.24 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ASN . . . . . 0.46 ' HA ' HG12 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 71.54 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 52.14 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 51.31 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' VAL . . . . . 0.46 HG12 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 70.41 108.466 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 64.51 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 71.4 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' ILE . . . . . 0.591 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 62.13 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 192' ' ' MET . . . . . 0.591 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 54.12 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 61.55 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 73.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.42 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 199' ' ' TRP . . . . . 0.456 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 54.32 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 61.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 70.1 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 203' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -61.93 -42.46 99.13 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.82 -31.28 64.69 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 119.666 -0.813 . . . . 72.13 111.749 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.68 49.59 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 121.194 -0.202 . . . . 63.55 110.787 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 60.0 ttp -65.36 -43.67 90.11 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.304 0.573 . . . . 55.3 109.463 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 48.0 ttm -69.15 -30.31 68.52 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.472 -0.785 . . . . 54.13 110.65 -178.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.87 -34.69 75.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.76 0.314 . . . . 35.34 110.656 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.04 -39.13 75.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.818 0.818 . . . . 71.33 108.81 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -63.05 -41.22 99.43 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.029 -1.441 . . . . 65.13 110.167 175.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 139.93 -92.3 0.19 Allowed Glycine 0 N--CA 1.424 -2.116 0 N-CA-C 107.111 -2.396 . . . . 74.21 107.111 -176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 16.4 tt -173.13 120.75 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 CA-C-O 121.296 0.57 . . . . 65.02 110.582 172.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 47.2 t -91.82 -49.71 6.11 Favored 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.126 -1.435 . . . . 61.54 107.126 174.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 75.57 81.02 0.54 Allowed Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 111.146 -0.782 . . . . 74.54 111.146 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -117.16 146.66 43.05 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.679 -0.489 . . . . 63.13 109.679 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -148.97 122.44 9.1 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.297 -1.372 . . . . 74.1 107.297 -177.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -106.36 72.51 0.22 Allowed Glycine 0 C--N 1.302 -1.349 0 C-N-CA 120.147 -1.025 . . . . 43.35 112.433 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.8 tttp 69.75 -65.54 0.3 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.896 1.278 . . . . 73.44 110.873 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp 174.4 -63.73 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.958 -1.868 . . . . 61.12 105.958 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 223' ' ' ASP . . . . . 0.454 ' HB3' ' C ' ' A' ' 103' ' ' GLY . 11.7 m-20 . . . . . 0 C--N 1.301 -1.51 0 N-CA-C 107.361 -1.348 . . . . 62.11 107.361 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.451 0 N-CA-C 109.701 -0.481 . . . . 53.1 109.701 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.24 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.544 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 61.2 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 53.5 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.499 ' HB ' ' CZ ' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 60.14 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 64.43 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 53.34 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 54.4 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 50.1 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 74.44 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 73.25 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 54.01 111.997 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 65.34 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 62.11 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 52.32 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 72.21 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.552 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 50.32 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 64.04 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 61.1 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 71.03 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.587 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 61.12 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 34.11 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.666 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 61.24 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.24 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 72.51 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 54.43 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 HG21 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 63.2 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CZ ' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 64.24 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 72.11 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 71.21 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 64.03 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.423 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 61.44 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 72.14 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.478 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 71.1 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 70.04 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 53.12 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 63.22 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 39' ' ' SER . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 51.13 105.956 175.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.429 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 43.22 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 62.24 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 63.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 64.41 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 72.33 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 52.11 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 64.33 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.418 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 70.13 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.465 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 72.21 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.609 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 54.05 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 51.12 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 60.41 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.518 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 72.04 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 62.14 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.636 ' HD2' HG11 ' A' ' 180' ' ' VAL . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 44.32 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.489 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 71.33 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.52 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.458 ' N ' HD12 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 53.34 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.52 ' HE1' HG22 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 70.4 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.12 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 129' ' ' TRP . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 63.22 108.814 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 72.31 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 71.35 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 53.23 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.532 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 64.45 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 65.42 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 129' ' ' TRP . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.23 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 72.33 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.593 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.437 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.5 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.568 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 65.51 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.482 ' O ' HG22 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.489 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.42 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.482 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 51.31 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 73.2 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 70.22 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 65.53 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 63.23 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.423 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 55.43 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . 0.593 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 54.53 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 62.32 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 64.13 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 53.52 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 65.31 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 70.33 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . 0.636 HG11 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 41.14 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 186' ' ' ILE . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 63.31 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 70.43 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 61.44 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 72.33 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 181' ' ' SER . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.45 HG21 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.03 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.609 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 71.1 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 73.24 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 64.15 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.3 108.795 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 64.23 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 74.51 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 45.22 110.412 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 . . . . . 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.421 -1.889 0 CA-C-O 121.429 0.633 . . . . 75.14 111.327 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 64.12 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.2 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.456 ' HG3' HG13 ' A' ' 111' ' ' VAL . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 71.44 109.33 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.479 HD13 ' HE2' ' A' ' 82' ' ' LYS . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.531 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 70.24 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' HG11 ' A' ' 111' ' ' VAL . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 63.52 110.926 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 70.13 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 55.52 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 65.22 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 55.45 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 53.32 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 71.51 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.693 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 73.11 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 72.41 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.593 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 64.21 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.666 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 64.53 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.469 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 55.32 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.22 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 53.33 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 54.12 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 55.25 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 65.42 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 72.31 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 62.41 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 70.11 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 63.21 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 61.34 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.41 ' O ' HG23 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.04 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.412 HD12 HD21 ' A' ' 179' ' ' LEU . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.479 ' HE2' HD13 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 53.54 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 64.03 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 70.04 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 65.22 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 91' ' ' GLU . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 73.52 110.411 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 73.12 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 62.44 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 74.54 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 53.11 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 65.32 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 108' ' ' MET . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.515 ' O ' HG23 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 63.41 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 104' ' ' ASP . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 72.13 110.949 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.531 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 73.2 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.464 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 44.32 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 64.22 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 63.44 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 71.24 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.405 ' HG ' HG13 ' A' ' 176' ' ' VAL . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 64.01 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' HG11 ' A' ' 176' ' ' VAL . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 73.21 111.193 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 73.32 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.44 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 41.44 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 72.33 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 63.42 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 65.45 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.34 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 64.21 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 74.31 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 62.42 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 73.01 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.54 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 51.24 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 73.23 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 63.02 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.479 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.451 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 70.23 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 44.14 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 63.04 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.456 ' HA ' ' HG3' ' A' ' 28' ' ' LYS . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 60.41 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 72.2 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 61.53 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.506 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 74.54 110.938 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 51.01 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 74.34 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 72.43 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 55.22 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 45.31 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.55 HG11 ' HB2' ' A' ' 123' ' ' LYS . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.412 HD21 HD12 ' A' ' 81' ' ' LEU . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.13 113.144 -179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 61.33 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 185' ' ' MET . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.12 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . 0.455 ' HB3' ' HB3' ' A' ' 182' ' ' HIS . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 50.2 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 71.21 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 64.2 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 60.2 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . 0.485 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 74.01 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 72.21 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 . . . . . 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.43 111.576 -176.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 121.086 0.469 . . . . 75.3 110.459 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 71.02 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 73.23 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 112' ' ' LEU . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 53.22 109.374 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 71.2 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.404 ' HB2' ' CD2' ' A' ' 79' ' ' HIS . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 62.13 111.817 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 52.4 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.548 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 64.53 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.529 HG21 ' HG3' ' A' ' 99' ' ' ARG . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.519 ' O ' HG22 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 53.41 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 61.25 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.3 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 71.41 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 60.25 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 41.23 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.411 ' O ' HG22 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.11 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 43.11 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 73.03 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 HG23 ' A' ' 67' ' ' ILE . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.22 110.767 179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 71.42 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 71.52 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 62.32 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 73.24 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.404 ' CD2' ' HB2' ' A' ' 39' ' ' SER . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 71.15 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 73.31 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 71.12 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 65.34 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 53.24 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.2 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 63.03 111.376 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.1 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 63.15 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 41.12 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 63.53 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 71.04 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.525 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.13 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 53.24 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 61.22 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.657 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 45.24 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 62.12 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 60.11 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.439 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 64.1 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 52.52 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 53.34 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.432 HD21 HD11 ' A' ' 172' ' ' LEU . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 54.02 108.749 172.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.476 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.463 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 65.05 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 132' ' ' VAL . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 70.53 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 72.44 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HA ' HG12 ' A' ' 141' ' ' VAL . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 70.22 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 62.3 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 61.2 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 74.31 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 143' ' ' GLN . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 62.42 108.727 172.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.501 ' HG2' HG23 ' A' ' 141' ' ' VAL . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . 0.419 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 71.3 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 63.44 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 63.24 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 73.33 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 64.51 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.554 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 54.34 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.486 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 62.44 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.481 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 73.0 109.525 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 72.2 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 122' ' ' LEU . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 72.1 110.814 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 72.52 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 173' ' ' ALA . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 71.44 109.468 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 73.23 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.11 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 70.01 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.498 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 62.15 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 74.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 65.45 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 64.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 63.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 72.41 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 70.55 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 71.4 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 25.25 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.502 ' HB3' ' HA3' ' A' ' 158' ' ' GLY . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 62.53 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 82' ' ' LYS . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 70.14 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 78' ' ' PHE . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.22 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 72.31 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.486 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 65.34 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 52.21 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 74.4 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 72.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.452 HG21 ' HG3' ' A' ' 99' ' ' ARG . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 73.31 111.824 -174.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 72.41 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.748 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.66 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 74.34 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.486 ' O ' HG22 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.66 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 72.02 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.541 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.01 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 60.13 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 65.2 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 54.13 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 61.2 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 63.11 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.472 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 55.15 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 51.35 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CD2' HD12 ' A' ' 34' ' ' LEU . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 62.23 110.63 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.407 ' HG ' HD11 ' A' ' 179' ' ' LEU . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 43.32 111.976 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 72.11 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 43.42 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.41 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.46 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 55.31 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' H ' ' HG2' ' A' ' 91' ' ' GLU . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.21 111.968 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 55.21 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 72.11 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 71.32 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.2 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 55.1 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.748 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 71.3 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.417 ' SD ' HD23 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 72.24 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.514 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 72.32 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 73.31 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.488 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 61.22 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 52.7 t-80 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 71.34 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.21 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 64.22 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.506 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 45.02 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 64.42 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 63.4 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 72.54 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 44.54 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.638 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 71.34 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 54.05 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.638 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 72.2 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 54.14 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 50.53 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 34.34 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 35.13 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 72.12 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 44.54 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 42.22 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 73.4 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.518 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 71.31 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.505 ' O ' HG22 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.05 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.22 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 65.53 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 54.33 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 73.34 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 26' ' ' SER . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.478 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 71.12 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 72.14 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 65.14 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 33.51 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.41 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 62.44 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.518 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 74.31 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.422 ' CD1' HG22 ' A' ' 142' ' ' ILE . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 74.11 111.348 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 61.11 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 72.52 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 61.3 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 70.04 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 73.43 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 54.15 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 64.22 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.587 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 70.13 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.13 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 74.22 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 64.52 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 74.35 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 192' ' ' MET . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 65.01 110.572 -176.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 60.32 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 70.23 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 64.22 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 44.31 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.645 0 N-CA-C 107.737 -1.209 . . . . 71.0 107.737 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.11 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.01 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 61.25 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 65.23 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.434 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 73.15 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 54.1 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.604 ' HB2' HG11 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.1 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 71.33 110.799 -177.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 71.24 111.047 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 63.11 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.02 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.22 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 73.3 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.723 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 64.11 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.605 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.14 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.552 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 72.05 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 61.53 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 51.21 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 63.5 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 62.14 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.4 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.454 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 61.14 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.65 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 64.24 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.426 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 64.03 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 21.32 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.33 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.02 109.488 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 71.4 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 61.31 111.948 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.464 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 73.45 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 65.23 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 51.42 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 52.13 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 73.34 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 51.15 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 74.32 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 64.4 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 51.05 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 72.03 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.723 ' HG3' HG21 ' A' ' 47' ' ' THR . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 53.2 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 70.11 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 72.32 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 65.15 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 64.13 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 34' ' ' LEU . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 53.43 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 61.33 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.462 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 74.44 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.462 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 65.41 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.753 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.404 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 43.41 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 71.04 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 62.34 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.503 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 73.53 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 62.34 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 53.4 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.503 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 52.01 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' HG12 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.35 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 72.15 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 51.55 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 71.13 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.444 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 62.22 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 71.34 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 64.24 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 64.51 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . 0.444 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 63.23 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 63.54 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.507 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.33 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.753 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.42 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 43.1 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 41.04 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.474 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 64.14 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 62.34 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 40.11 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 74.45 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 50.44 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 71.24 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 73.23 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 176' ' ' VAL . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 53.44 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 62.01 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.42 HG12 ' O ' ' A' ' 172' ' ' LEU . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 50.25 110.742 -176.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 63.31 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 23.05 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.493 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 61.0 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.565 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 32.44 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.565 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 64.23 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 51.15 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 74.43 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 74.31 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 71.44 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 63.31 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 62.04 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 44.44 109.57 178.208 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 71.45 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.516 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 64.45 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 32' ' ' ASP . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 72.14 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HB3' ' HA ' ' A' ' 29' ' ' GLU . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 34.35 110.187 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 55.14 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 40.52 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 54.34 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.497 HH22 HD23 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 65.32 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 60.35 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 64.0 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 65.31 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 64.21 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.667 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 42.13 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 63.11 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 44.22 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 72.42 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 70.34 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.452 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 73.42 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 60.23 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 74.32 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 72.13 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 72.03 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 54.42 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.674 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 42.01 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 54.25 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 32.01 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 65.2 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 42.53 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 72.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 64.24 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 62.42 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.43 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 63.34 110.828 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 73.12 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.43 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 62.01 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.401 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 74.43 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.23 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 91' ' ' GLU . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 54.11 110.778 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 43.44 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 61.22 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 40.3 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 65.44 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 63.22 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.421 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 61.35 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 72.33 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.469 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 62.42 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 61.51 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 74.11 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 52.13 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 71.12 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 53.5 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.11 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 73.53 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 72.12 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.04 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.01 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 64.55 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 71.21 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 64.24 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 65.43 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.529 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 70.01 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 71.33 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 71.14 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.603 ' HA ' HG12 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 71.22 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 65.11 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . 0.425 ' HB3' ' HB ' ' A' ' 139' ' ' THR . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 62.41 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.425 ' HB ' ' HB3' ' A' ' 135' ' ' SER . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 71.43 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.529 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 54.21 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 42.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.469 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 61.23 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . 0.509 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 55.12 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 54.43 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.13 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.509 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 72.04 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.522 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 62.24 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 64.35 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.522 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 72.24 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 63.03 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . 0.516 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 43.35 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.452 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 52.42 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 43.31 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 74.4 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 53.23 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 71.31 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.473 HD22 HG22 ' A' ' 142' ' ' ILE . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 65.24 109.299 -175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 64.04 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.463 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 71.12 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 72.41 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 55.54 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 52.25 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 64.55 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.454 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 61.41 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.443 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . 0.454 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 73.43 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 60.21 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.725 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 63.15 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.454 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 72.41 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . 0.404 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 74.0 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.725 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 73.21 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 62.15 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 . . . . . 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . . . . . . 0 N--CA 1.422 -1.836 0 CA-C-O 120.774 0.321 . . . . 64.23 110.755 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 71.24 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 71.34 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 70.25 111.128 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 61.3 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.484 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 71.32 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.31 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 71.54 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 64.45 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 64.43 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 62.25 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 53.01 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 74.34 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 64.43 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.743 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 52.42 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 73.53 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 64.52 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.647 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 64.31 110.769 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.32 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 65.32 110.623 -177.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.458 HG23 ' HB1' ' A' ' 64' ' ' ALA . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.35 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 71.14 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 73.14 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 11.1 m120 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 64.14 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 72.34 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB1' HG23 ' A' ' 56' ' ' VAL . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 64.34 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 55.21 110.881 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 70.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.51 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.01 108.153 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 63.25 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.22 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 60.44 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 54.23 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 61.22 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 60.43 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HE1' ' O ' ' A' ' 90' ' ' ASN . 56.3 t-80 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.912 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 45.3 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 164' ' ' LEU . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 54.34 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 79' ' ' HIS . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 72.1 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 64.51 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 71.11 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 71.34 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.743 ' HG3' HG21 ' A' ' 47' ' ' THR . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 73.41 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 61.05 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.609 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 63.33 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 44.34 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 71.4 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 73.52 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.484 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 41.2 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 53.44 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 72.14 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 119' ' ' LEU . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 53.33 112.021 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 71.22 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 72.42 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 70.22 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.594 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.481 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 42.04 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.506 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.594 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 64.12 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 73.4 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 64.41 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.493 ' HA ' HG12 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 71.1 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 42.44 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . 0.576 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 61.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 71.54 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 31.11 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.576 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 64.2 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 71.11 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 72.14 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 73.1 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 73.23 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . 0.43 ' HB2' HG23 ' A' ' 142' ' ' ILE . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.12 109.057 -176.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.454 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.431 ' O ' HG22 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 71.51 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 73.35 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 74.2 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.626 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 62.44 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 74.24 110.763 -176.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.1 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 54.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.04 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 71.45 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.02 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.468 HD21 ' HB ' ' A' ' 126' ' ' ILE . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 73.24 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 63.25 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 73.04 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 63.52 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.501 ' HA ' HG22 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 64.43 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . 0.501 HG22 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 70.11 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.04 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 60.32 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.461 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.43 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.461 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 53.31 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 71.21 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 63.42 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 60.32 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 63.13 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 73.1 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 50.55 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 . . . . . 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -1.794 0 N-CA-C 109.212 -0.662 . . . . 72.24 109.212 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 70.11 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.443 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 71.31 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 72.31 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 32.3 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 70.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 64.34 108.945 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 52.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.607 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 71.31 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 65.12 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.566 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.634 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 61.43 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 64.33 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.35 109.897 -175.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 55.23 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 61.44 112.237 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 61.21 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 71.5 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.589 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 70.32 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 63.2 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 54.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 33.51 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 72.23 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.463 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.2 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 98' ' ' ASN . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.49 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 64.41 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 70.42 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 71.33 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 65.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.414 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 33.23 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 53.23 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 63.04 111.505 178.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.02 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 74.22 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.12 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 71.42 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.455 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 72.02 107.301 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 62.15 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 72.44 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.55 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 44.05 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.468 ' HA ' HD21 ' A' ' 72' ' ' LEU . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 63.1 111.418 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.634 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 35.31 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.499 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 40.25 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 63.41 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.51 ' O ' HG23 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 63.34 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.572 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 70.24 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.53 ' HA ' ' ND2' ' A' ' 189' ' ' ASN . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 43.22 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.32 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 73.13 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 63.5 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 35.51 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 55.34 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 64.51 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.625 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 64.31 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 73.01 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.625 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 51.11 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 72.03 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' A' ' 129' ' ' TRP . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 64.52 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 61.41 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 53.13 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 73.11 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 52.21 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 71.31 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.512 HG23 ' HG2' ' A' ' 143' ' ' GLN . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.11 109.389 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HA ' HD12 ' A' ' 169' ' ' LEU . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 65.3 112.594 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 62.15 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.22 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.492 ' HB2' ' HH2' ' A' ' 129' ' ' TRP . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 62.43 109.727 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 72.15 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 73.44 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 73.12 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 41.51 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 55.14 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 45.2 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 64.2 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 55.34 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 55.14 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . 0.456 ' H ' HD13 ' A' ' 169' ' ' LEU . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.461 ' HB2' HG12 ' A' ' 167' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 62.24 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 63.14 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 62.14 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.449 ' O ' HD13 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 64.44 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.02 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.449 HD13 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 40.14 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . 0.417 ' HA ' HD11 ' A' ' 186' ' ' ILE . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 60.21 111.136 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.53 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 64.55 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . 0.567 ' HA ' HG22 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.22 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 51.14 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 185' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . 0.53 ' ND2' ' HA ' ' A' ' 113' ' ' SER . 28.1 t-20 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 65.42 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.572 ' SD ' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 53.04 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 64.32 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.33 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 64.24 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 53.15 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 74.44 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 60.2 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 62.11 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 53.41 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 71.31 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 . . . . . 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 64.23 110.8 176.746 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.003 0 CA-C-O 120.743 0.306 . . . . 73.51 111.053 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 53.3 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 82' ' ' LYS . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 64.43 110.459 176.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 65.13 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 71.5 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.48 HD21 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.13 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 70.11 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.676 HG21 ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 62.12 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 72.02 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.684 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 14.0 m120 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 53.43 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 44.2 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.473 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 67' ' ' ILE . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 63.45 112.397 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 57' ' ' LYS . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 64.31 108.039 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 73.52 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 52.51 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 71.3 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.41 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 34.31 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.495 ' HB ' HG21 ' A' ' 56' ' ' VAL . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 63.01 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 71.24 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 72.24 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 73.12 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 38' ' ' TYR . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.619 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 53.21 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.504 ' OE1' ' HG3' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 63.55 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 62.21 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 72.31 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 73.0 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.545 HD13 HG23 ' A' ' 176' ' ' VAL . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.31 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HB3' HG23 ' A' ' 31' ' ' ILE . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.12 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.488 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 52.15 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 71.21 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 65.44 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 72.14 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 43.14 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 53.53 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.529 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.416 ' N ' HD22 ' A' ' 98' ' ' ASN . 0.8 OUTLIER -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 60.0 111.26 -177.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.684 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 73.2 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 72.41 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 61.23 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 53.34 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 74.24 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 61.21 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 62.25 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 61.45 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.693 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 55.3 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.424 HG22 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 73.22 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 53.41 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 71.03 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.693 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 73.43 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.517 HD21 HG21 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.453 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 73.02 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.44 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 64.22 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.436 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 64.45 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.664 ' O ' HG12 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 130' ' ' LYS . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 72.51 107.694 171.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 61.54 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.0 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 61.2 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.575 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 72.12 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 61.54 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 41.12 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.502 HD13 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 64.01 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 64.41 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . 0.46 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 72.02 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . 0.4 ' HB2' HG23 ' A' ' 142' ' ' ILE . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 63.33 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HB2' HD13 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 64.41 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 70.1 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 72.41 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 72.45 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.14 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 65.32 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.406 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 62.21 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 70.41 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 20.23 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 73.13 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 64.14 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.419 ' HB3' HG23 ' A' ' 126' ' ' ILE . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 62.3 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 64.01 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.25 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.545 HG23 HD13 ' A' ' 81' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 52.51 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 61.33 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 72.34 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 53.44 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 53.01 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 71.04 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 45.21 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 60.31 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 43.12 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 54.2 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 64.04 109.351 178.696 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB3' ' NE2' ' A' ' 30' ' ' GLN . . . . . . . . 0 N--CA 1.43 -1.429 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.518 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 65.23 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.22 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.518 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 54.42 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 73.54 108.977 176.177 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 71.03 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 65.13 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 63.31 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 64.54 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.733 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 42.14 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 73.45 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 74.14 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 43.1 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.532 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 61.41 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 62.12 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.431 ' HA ' HG22 ' A' ' 56' ' ' VAL . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 63.32 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' A' ' 53' ' ' ASP . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 71.54 110.276 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 62.0 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 60' ' ' LEU . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' LEU 0.262 0.9 OUTLIER 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 63.03 113.274 -175.969 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 63.11 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.43 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 54.13 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.496 HD12 ' H ' ' A' ' 67' ' ' ILE . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 52.12 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.505 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 34.34 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 73.03 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 71.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.733 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 43.11 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.45 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.14 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.54 ' HE2' HD13 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.443 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 54.33 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 70.23 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.443 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 63.13 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 64.1 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 71.15 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 63.22 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.408 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 65.51 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 61.03 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 44.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 63.24 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 72.1 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 41.24 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 65.03 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.478 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 63.31 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 61.43 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 71.31 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 64.31 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 63.04 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 70.22 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.509 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 65.22 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 62.53 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.526 ' HB3' HD13 ' A' ' 27' ' ' LEU 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 119' ' ' LEU . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 71.45 110.862 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.669 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 73.31 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.04 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 60.13 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 65.54 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.516 ' HH2' ' HB2' ' A' ' 153' ' ' TRP 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 73.1 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 62.21 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HB3' ' HE3' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 41.41 109.46 175.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 54.11 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 64.42 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 74.1 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 54.31 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 63.33 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.474 HG21 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 62.24 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 72.55 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.44 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.442 HG21 HD21 ' A' ' 169' ' ' LEU . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 60.44 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.669 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 159' ' ' PHE . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 55.11 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.534 ' ND1' HD12 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 53.53 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.545 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 150' ' ' THR . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 71.43 110.084 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . 0.412 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 173' ' ' ALA . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 61.12 111.278 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 72.33 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.13 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 177' ' ' ASN . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 61.43 111.735 -177.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 50.14 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.489 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.14 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 73.42 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 70.43 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . 0.554 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 63.34 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.25 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 71.04 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . 0.416 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 50.31 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 45.11 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 63.41 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 71.11 110.409 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 40.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 63.31 110.434 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 62.01 111.172 -177.607 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 N-CA-C 109.876 -0.416 . . . . 62.32 109.876 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.506 HD13 ' HB3' ' A' ' 118' ' ' GLU . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 70.24 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 53.04 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 53.24 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.03 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 62.31 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 52.34 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 63.44 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 55.42 108.562 173.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 64.3 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 72.11 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 54.35 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.31 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.637 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 74.42 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CE2' HG22 ' A' ' 47' ' ' THR . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 71.52 109.882 175.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.21 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HA ' HG22 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 62.23 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 60.01 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 72.3 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.498 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 52.22 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 73.2 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.04 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 65.12 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 72.34 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 41.41 111.464 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.498 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 65.41 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 62.41 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 70.21 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 61.32 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 72.35 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 60.21 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 63.34 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 61.35 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 72.41 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 91' ' ' GLU . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 74.14 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 62.42 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 53.44 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.22 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 53.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.01 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 61.51 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.637 ' HG3' HG21 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 72.05 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.521 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.462 ' O ' HG23 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.05 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.702 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 54.11 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 65.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 60.01 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 64.43 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 73.21 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.506 ' HB3' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 55.22 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.482 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.45 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 54.33 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 71.14 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 72.13 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.553 HG23 HD12 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 72.1 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.618 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 52.14 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 71.43 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 43.4 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 54.44 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 53.14 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.458 HD12 ' HB2' ' A' ' 129' ' ' TRP . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 71.05 109.573 177.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.639 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 72.32 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 61.5 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.495 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 71.14 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 61.41 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 53.03 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 61.44 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 64.25 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 160' ' ' LYS . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 61.15 107.905 -178.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 62.4 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 63.12 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 72.11 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 60.02 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 63.34 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.529 ' H ' HG22 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 52.23 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 72.43 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.53 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 70.4 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 51.04 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 45.1 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 63.31 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 61.1 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 44.34 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 63.15 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 188' ' ' ILE . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 62.24 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 184' ' ' ASP . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 62.11 110.038 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 60.21 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 72.1 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 54.21 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.702 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 72.1 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 60.15 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 64.55 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 72.02 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 64.33 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 62.41 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 70.55 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 62.31 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.498 0.666 . . . . 74.24 111.643 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 33.13 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 62.01 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HE2' ' SG ' ' A' ' 86' ' ' CYS . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 73.33 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 60.32 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 82' ' ' LYS . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 70.44 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 72.21 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 70.3 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 73.42 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 73.44 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 73.22 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 61.12 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.757 HG21 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.24 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.33 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 73.43 113.849 176.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 71.42 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.499 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 14.8 m120 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 55.12 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 50.13 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 65.21 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.439 HD22 HD21 ' A' ' 195' ' ' ASN . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 53.34 112.482 -173.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 45.44 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 62.12 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.428 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 43.13 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 64.45 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 70.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 43.15 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 55.24 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 52.22 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.418 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HZ1' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 70.3 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 62.1 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 45.14 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 45.23 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 71.05 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 50.1 110.449 -176.124 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 64.54 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 60.12 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.483 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 72.12 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 61.12 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 61.42 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 64.04 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 52.22 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 54.01 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 72.53 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.602 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.401 ' HG ' ' HG3' ' A' ' 192' ' ' MET . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 71.1 111.631 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 60.04 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 64.14 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 70.42 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.487 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 63.13 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 63.03 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 71.35 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 63.45 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 43.12 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.484 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 63.31 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.428 ' O ' HG23 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 70.14 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.473 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 63.22 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 62.23 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.21 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 62.43 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 65.34 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 65.01 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.467 HD12 HD22 ' A' ' 172' ' ' LEU . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 62.14 111.495 -176.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.612 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 64.05 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 70.54 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 65.34 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.614 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 73.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 62.4 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.12 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 43.34 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.481 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.619 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 70.35 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.619 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 73.32 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.01 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.14 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . 0.467 HD22 HD12 ' A' ' 145' ' ' ILE . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 72.25 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.01 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 172' ' ' LEU . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 65.25 110.906 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 63.43 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 63.43 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.21 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 52.4 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 61.43 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.453 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 71.35 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 73.45 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 52.4 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 63.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.401 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 53.35 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 54.35 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . 0.439 HD21 HD22 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 61.05 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . 0.45 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 64.22 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 72.44 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 71.41 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 50.14 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 65.15 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 . . . . . 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 73.45 110.104 178.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.22 0 N-CA-C 108.71 -0.848 . . . . 65.54 108.71 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 64.25 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 71.53 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.03 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.432 HG23 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 74.52 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.47 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 41.35 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 71.23 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 55.21 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 33.03 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 61.21 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 73.32 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.21 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.578 HG21 ' HG3' ' A' ' 99' ' ' ARG . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 54.01 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 63.41 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 62.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.527 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.12 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 65.41 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.447 HG11 HG12 ' A' ' 67' ' ' ILE . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 74.41 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 71.41 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.456 ' N ' HD22 ' A' ' 61' ' ' ASN . 0.8 OUTLIER 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 74.03 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 52.21 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.447 HG12 HG11 ' A' ' 56' ' ' VAL . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 60.35 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 73.5 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 53.31 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 71.34 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 65.11 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 62.21 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.427 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 71.44 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.432 ' CZ ' HG23 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 27.0 t-80 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.427 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 70.13 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 61.0 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.22 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 44.22 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.03 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.573 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 71.23 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 43.14 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.578 ' HG3' HG21 ' A' ' 47' ' ' THR . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 62.22 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 74.24 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 61.24 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 52.25 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 54.11 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 62.22 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.567 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 62.14 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 70.11 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' SER . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 61.21 110.045 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 73.43 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.12 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.467 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 42.1 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 73.33 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.423 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 61.12 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 61.24 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.459 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 64.44 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 73.22 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.582 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 65.12 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.582 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 71.44 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 53.14 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 71.34 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 51.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 53.25 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 62.23 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.447 HG22 ' HG ' ' A' ' 169' ' ' LEU . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.25 108.169 -177.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . 0.514 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.557 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 63.12 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.402 ' HD2' ' CG ' ' A' ' 166' ' ' ASP . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 71.41 111.362 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.431 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 62.34 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 72.22 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 64.25 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.623 ' ND1' HD12 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 63.32 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 63.43 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 64.22 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.573 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . 0.557 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 142' ' ' ILE . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 63.13 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 64.11 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 72.1 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 43.13 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.454 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 63.44 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.444 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 60.52 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.444 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 70.1 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . 0.48 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . 0.554 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 43.3 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 64.11 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 63.45 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.24 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 64.53 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . 0.464 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 65.25 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . 0.41 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 204' ' ' SER . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 73.13 108.762 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 201' ' ' LYS . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 . . . . . 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 44.1 111.754 179.024 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.948 0 CA-C-O 121.341 0.591 . . . . 55.04 110.903 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 64.1 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.576 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 64.34 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 71.34 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.504 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 62.41 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 50.35 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 65.14 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 63.01 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 71.01 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 55.34 110.372 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 64.15 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 63.24 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 55.0 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 74.45 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.13 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.594 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 54.55 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 45.02 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 73.23 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 63.44 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 72.14 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.42 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 71.41 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 54.44 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 42.54 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.511 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.11 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 71.1 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 62.22 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 55.52 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.31 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 64.22 109.087 169.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.695 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 60.12 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 55.05 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 54.33 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 71.24 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 72.11 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 53.04 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 64.1 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 52.34 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 61.14 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 74.31 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 65.11 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 63.24 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 54.2 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.454 ' O ' ' HA ' ' A' ' 39' ' ' SER . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 53.43 106.881 176.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 63.42 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.3 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.716 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 64.13 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 51.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.21 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.45 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 51.21 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 52.32 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 40.14 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 180' ' ' VAL . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 63.03 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.603 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 71.31 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 71.42 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 54.34 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.603 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 72.11 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.12 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 64.51 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.14 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.43 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.421 ' HA ' HG12 ' A' ' 141' ' ' VAL . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 63.22 109.435 -172.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 70.44 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 60.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 42.14 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 65.15 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 133' ' ' LYS . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 72.32 108.042 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 64.14 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 52.04 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . 0.533 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 64.12 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.405 ' O ' ' HB ' ' A' ' 150' ' ' THR . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 64.12 110.322 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 54.42 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 74.31 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.439 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 72.15 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 64.12 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.403 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.47 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 71.42 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 54.03 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 63.34 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.572 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 70.4 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.572 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 72.51 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . 0.533 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.403 ' H ' HD12 ' A' ' 145' ' ' ILE . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 62.51 107.918 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 126' ' ' ILE . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 61.51 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 52.42 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 60.21 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . 0.564 ' HA ' ' HE2' ' A' ' 116' ' ' HIS . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 44.32 111.222 -179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 72.32 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 54.33 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . 0.418 ' N ' HD12 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.23 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 41.35 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.488 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 34.21 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . 0.629 ' HA ' HG22 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 74.33 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . 0.42 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 71.11 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 61.45 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 54.12 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 62.02 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 . . . . . 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . . . . . . 0 N--CA 1.408 -2.57 0 N-CA-C 109.447 -0.575 . . . . 55.14 109.447 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' A' ' 157' ' ' HIS . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.228 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.421 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 63.21 111.518 -174.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 53.53 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.509 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 71.43 111.089 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.505 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 64.24 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.11 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 71.12 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 73.55 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 24.13 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 43.12 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 52.23 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.556 HG22 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 54.42 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 43.23 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.556 ' CZ2' HG22 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 61.44 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 102' ' ' PRO . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 71.25 107.688 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.45 ' HA ' HG22 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.554 ' O ' HD13 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.45 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 62.31 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 64.44 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 62.53 113.788 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.42 ' O ' HG22 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 60' ' ' LEU . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.13 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 HD21 ' A' ' 109' ' ' LEU . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.456 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.498 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 71.3 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.548 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.0 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.465 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.04 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 63.5 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 54.12 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 65.34 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 81' ' ' LEU . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 71.23 112.699 178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 73.31 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 81' ' ' LEU . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 74.2 110.288 175.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.442 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 72.15 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 65.25 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 65.3 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 62.23 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 55.41 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 71.42 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 53.5 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.548 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.476 ' HA ' HD21 ' A' ' 72' ' ' LEU . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.537 ' HG3' HG21 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 72.52 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 72.0 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.463 ' HA ' HG23 ' A' ' 52' ' ' THR . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 71.12 114.883 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 45.03 112.019 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 72.11 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.458 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 73.2 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 71.24 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 70.32 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 62.42 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 73.01 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 70.45 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . 0.406 ' HB3' HG21 ' A' ' 180' ' ' VAL . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.02 111.423 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 55.55 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 71.31 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 73.24 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.03 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.535 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.535 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 127' ' ' ASP . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 73.4 109.353 171.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 131' ' ' LYS . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 74.15 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.62 ' HA ' HG12 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 61.42 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.549 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 74.42 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 45.22 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.483 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.409 ' HA ' HD22 ' A' ' 169' ' ' LEU . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.449 HG22 ' H ' ' A' ' 167' ' ' VAL . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 31.31 110.244 177.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 71.3 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . 0.487 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 41.42 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 65.55 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ASN . . . . . 0.445 ' O ' HG22 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.42 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' TRP . . . . . 0.477 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 64.12 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 50.12 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' HIS . . . . . 0.404 ' O ' ' HB3' ' A' ' 26' ' ' SER . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 45.12 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.23 111.42 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . 0.538 ' HB3' ' HG2' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 73.41 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' ASN . . . . . 0.451 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.449 ' H ' HG22 ' A' ' 145' ' ' ILE . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 71.13 107.535 -176.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 72.2 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 72.32 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 44.4 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 62.12 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.24 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ASN . . . . . 0.46 ' HA ' HG12 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 71.54 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 52.14 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 51.31 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' VAL . . . . . 0.46 HG12 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 70.41 108.466 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 64.51 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 71.4 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' ILE . . . . . 0.591 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 62.13 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' MET . . . . . 0.591 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 54.12 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 61.55 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 73.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.42 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' TRP . . . . . 0.456 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 54.32 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 61.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 70.1 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 . . . . . 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.241 0.643 0 N-CA-C 111.844 0.313 . . . . 45.3 111.844 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.4 m -75.86 -34.11 60.03 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 112.901 0.704 . . . . 61.33 112.901 -176.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -164.47 -161.97 14.56 Favored Glycine 0 CA--C 1.477 -2.292 0 C-N-CA 120.279 -0.962 . . . . 73.53 110.93 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.9 mt -84.22 109.97 18.22 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.992 0 N-CA-C 106.405 -1.702 . . . . 74.2 106.405 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -130.16 120.62 24.85 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.94 -0.704 . . . . 73.03 110.999 -175.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -122.78 -98.45 1.41 Allowed Glycine 0 N--CA 1.417 -2.62 0 N-CA-C 109.077 -1.609 . . . . 60.14 109.077 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.1 t -154.07 108.49 3.05 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.958 -1.127 . . . . 72.51 107.958 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.4 m -81.19 105.83 12.7 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 116.177 -0.465 . . . . 64.43 110.799 -178.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -134.13 159.15 41.72 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 109.63 -0.507 . . . . 73.3 109.63 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -87.55 145.79 26.07 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.174 -1.417 . . . . 60.23 107.174 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.27 -13.55 37.83 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.653 0.612 . . . . 74.24 112.653 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -110.81 158.31 18.82 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-O 121.105 0.478 . . . . 75.13 110.06 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.0 ttm180 -112.87 110.06 19.91 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 107.218 -1.401 . . . . 74.41 107.218 174.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -74.07 -48.49 29.45 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.118 -0.946 . . . . 75.33 110.406 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.7 m -76.08 102.48 5.71 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.16 -0.927 . . . . 51.14 111.653 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 64.5 t -103.05 100.85 11.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.648 -1.241 . . . . 64.21 107.648 174.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.7 t -74.06 102.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 108.758 -0.83 . . . . 74.24 108.758 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.85 153.57 23.95 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 115.779 -0.646 . . . . 71.2 110.066 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.79 103.68 0.88 Allowed Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.129 -0.789 . . . . 63.21 111.129 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.29 112.69 20.53 Favored 'General case' 0 N--CA 1.425 -1.72 0 N-CA-C 109.922 -0.399 . . . . 74.42 109.922 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.1 t -78.79 116.48 19.16 Favored 'General case' 0 N--CA 1.419 -2.013 0 N-CA-C 108.198 -1.038 . . . . 62.54 108.198 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.9 m -69.19 111.13 4.93 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 115.355 -0.839 . . . . 61.13 111.945 -176.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 63.4 t -77.51 110.49 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 107.129 -1.434 . . . . 63.14 107.129 174.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 75.05 109.96 0.07 Allowed 'General case' 0 C--O 1.248 0.975 0 C-N-CA 125.422 1.489 . . . . 73.04 109.054 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.34 170.32 16.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.964 -0.562 . . . . 53.1 109.701 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.8 m -82.26 177.59 8.7 Favored 'General case' 0 N--CA 1.415 -2.22 0 N-CA-C 108.263 -1.014 . . . . 61.24 108.263 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.544 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.6 mm? -69.07 -31.21 69.8 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-O 121.218 0.532 . . . . 72.31 110.324 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 32' ' ' ASP . 0.2 OUTLIER -64.28 -46.63 82.81 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 115.824 -0.626 . . . . 73.11 110.06 -179.539 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -74.68 -27.91 60.61 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.224 -0.59 . . . . 61.2 110.804 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -66.2 -49.8 66.07 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 123.615 0.572 . . . . 53.5 109.474 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.499 ' HB ' ' CZ ' ' A' ' 78' ' ' PHE . 37.7 pt -75.37 -26.37 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-O 121.366 0.603 . . . . 60.14 110.807 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 1.4 t70 -76.08 -29.56 57.98 Favored 'General case' 0 N--CA 1.417 -2.122 0 N-CA-C 109.032 -0.729 . . . . 64.43 109.032 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 81.1 t90 -69.09 -38.82 79.17 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.416 -0.957 . . . . 53.34 108.416 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.47 -44.44 89.28 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 115.433 -0.803 . . . . 54.4 109.426 175.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.41 86.11 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.474 -0.785 . . . . 50.1 110.553 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -61.14 -40.32 93.39 Favored 'General case' 0 CA--C 1.497 -1.085 0 C-N-CA 124.152 0.981 . . . . 74.53 112.101 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -65.6 -41.43 92.78 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 119.977 -0.689 . . . . 74.44 110.185 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' CE1' HG13 ' A' ' 96' ' ' VAL . 29.4 t80 -69.16 -31.93 70.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.419 . . . . 73.25 111.441 178.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 25.1 m -93.26 18.99 8.64 Favored 'General case' 0 N--CA 1.416 -2.138 0 C-N-CA 123.55 0.74 . . . . 54.01 111.997 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -109.59 125.31 52.43 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-O 120.972 0.415 . . . . 73.43 111.165 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -84.9 130.67 34.61 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.706 -0.849 . . . . 73.21 108.706 175.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -131.44 33.29 4.09 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.458 0.647 . . . . 65.34 109.523 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.6 m -67.33 -11.87 58.72 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 115.016 -0.993 . . . . 62.11 110.45 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -67.12 -12.92 61.31 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 122.32 1.057 . . . . 52.32 109.444 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -104.52 123.18 47.05 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 114.556 -1.202 . . . . 72.21 108.492 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.26 108.62 15.85 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 105.976 -1.861 . . . . 72.13 105.976 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.552 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.2 p -88.7 79.04 7.58 Favored 'General case' 0 N--CA 1.411 -2.384 0 C-N-CA 119.456 -0.898 . . . . 50.32 111.493 -173.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 32.5 m -79.56 86.95 5.16 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.115 -0.948 . . . . 75.33 109.75 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm 46.02 77.22 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 125.506 1.522 . . . . 75.05 113.672 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 44.1 m0 -72.52 120.31 17.95 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.008 -1.108 . . . . 75.35 108.008 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -93.04 61.67 3.47 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.016 0.912 . . . . 73.31 110.035 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.2 m -83.35 -46.0 13.09 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 107.249 -1.389 . . . . 74.34 107.249 175.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -66.71 -26.08 66.84 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 114.583 -1.189 . . . . 74.13 111.158 -177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -83.28 -37.33 23.62 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-O 121.419 0.628 . . . . 74.11 109.526 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -70.07 -40.31 75.12 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.489 -0.778 . . . . 74.21 109.968 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.6 m -75.32 -18.52 15.98 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.409 0 CA-C-O 121.353 0.597 . . . . 64.04 110.855 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 0.2 OUTLIER -71.55 -27.82 63.43 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 109.076 -0.713 . . . . 74.31 109.076 175.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -87.66 -37.41 16.77 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 115.841 -0.618 . . . . 61.1 110.126 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 93.6 mt -92.91 -20.87 20.22 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 115.601 1.704 . . . . 71.03 115.601 -175.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.587 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.5 tt -126.78 10.17 7.07 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 118.325 0.511 . . . . 75.44 110.359 -172.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 m120 90.36 168.42 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 125.368 1.467 . . . . 72.15 110.654 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 57' ' ' LYS . 1.8 tm-20 -73.48 -13.72 61.11 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.141 0.972 . . . . 73.12 109.341 -175.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 47.2 mtmt -71.4 -9.16 57.72 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.386 -0.825 . . . . 71.54 110.882 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.51 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.1 12.29 26.95 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 123.312 0.645 . . . . 63.34 111.356 -179.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -59.91 126.5 17.78 Favored 'Isoleucine or valine' 0 C--O 1.245 0.838 0 CA-C-O 121.595 0.712 . . . . 61.12 110.965 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.41 54.34 20.4 Favored Glycine 0 C--N 1.315 -0.636 0 CA-C-N 114.941 -1.027 . . . . 34.11 110.878 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.666 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.1 tt -65.73 -43.64 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 N-CA-C 113.171 0.804 . . . . 61.24 113.171 -173.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.73 -37.05 83.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 118.615 0.643 . . . . 74.24 110.877 -175.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.5 m -63.41 -38.11 89.89 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -69.01 -42.64 76.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.679 -0.691 . . . . 72.51 109.299 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 51.2 mt -61.77 -44.39 96.99 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-N 115.583 -0.735 . . . . 73.44 111.473 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -77.78 -24.59 48.86 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 118.898 -1.121 . . . . 73.21 111.694 -178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.07 -43.0 72.05 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.8 0.333 . . . . 54.43 110.17 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.45 HG13 HG21 ' A' ' 188' ' ' ILE . 48.6 mm -72.37 -35.35 51.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-O 121.232 0.539 . . . . 73.11 110.149 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.87 78.62 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 116.244 -0.435 . . . . 74.2 110.088 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -59.15 -43.62 92.06 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.004 0.522 . . . . 74.55 110.736 172.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -59.55 -43.24 93.58 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 108.832 -0.803 . . . . 63.2 108.832 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.499 ' CZ ' ' HB ' ' A' ' 31' ' ' ILE . 68.5 t80 -72.08 -31.82 66.45 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.904 -0.589 . . . . 64.24 110.775 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -67.18 -39.71 86.46 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.17 -0.678 . . . . 72.11 109.17 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -55.96 -44.26 78.32 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.427 -0.806 . . . . 71.21 109.151 175.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 74.4 mt -74.81 -41.79 59.29 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.14 -0.936 . . . . 64.03 112.481 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -68.25 -24.95 64.96 Favored 'General case' 0 C--O 1.214 -0.766 0 O-C-N 122.226 -0.297 . . . . 75.55 110.956 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 15.3 p -71.96 -25.0 61.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.271 0.558 . . . . 65.41 110.881 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.52 -35.16 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 CA-C-N 115.648 -0.706 . . . . 73.41 109.594 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -84.69 -20.8 30.66 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 113.342 0.867 . . . . 73.33 113.342 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.423 ' C ' ' HB2' ' A' ' 165' ' ' ASN . 92.9 m -114.1 136.53 52.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.728 -0.608 . . . . 61.44 112.026 178.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.9 m -65.47 132.15 48.21 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.284 -0.871 . . . . 72.14 110.731 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.42 16.17 80.93 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 114.645 0.618 . . . . 63.25 114.645 173.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.478 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 64.8 t -105.0 127.42 59.57 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 CA-C-N 117.567 0.683 . . . . 71.1 110.371 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -82.6 151.38 26.39 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.889 -0.782 . . . . 70.04 108.889 -177.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.82 -7.52 59.61 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.606 0.965 . . . . 74.15 113.606 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 t -137.0 107.8 8.9 Favored Pre-proline 0 C--N 1.29 -2.019 0 CA-C-O 121.599 0.714 . . . . 73.43 111.23 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.52 159.53 46.04 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.758 2.305 . . . . 53.12 112.192 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.47 -37.55 9.54 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.319 -0.993 . . . . 63.22 108.319 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 39' ' ' SER . 81.1 m-70 -93.52 105.86 17.88 Favored 'General case' 0 N--CA 1.424 -1.745 0 N-CA-C 105.956 -1.868 . . . . 51.13 105.956 175.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.429 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.4 t -113.31 126.87 70.81 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 115.967 -0.561 . . . . 54.41 109.808 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.88 146.08 46.42 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.213 0.53 . . . . 70.11 111.57 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -120.37 -26.53 5.4 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.304 -0.862 . . . . 43.22 111.58 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 36.9 mmt180 -127.15 139.27 53.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.936 1.087 . . . . 62.24 113.936 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 62.2 t -122.37 124.63 71.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 107.487 -1.301 . . . . 74.15 107.487 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.5 m -84.75 159.9 56.98 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.245 -1.02 . . . . 63.12 108.245 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -52.33 -39.47 72.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.328 2.018 . . . . 64.41 111.575 174.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.12 -33.07 84.24 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-N 115.215 -0.902 . . . . 54.15 112.26 178.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -77.95 -36.52 49.07 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 109.346 -0.613 . . . . 71.2 109.346 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.94 -37.82 77.59 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 114.954 -1.021 . . . . 72.11 111.491 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.44 -35.33 72.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.977 0.418 . . . . 72.33 110.397 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 27.3 m -78.83 -41.42 30.17 Favored 'General case' 0 N--CA 1.421 -1.888 0 C-N-CA 119.474 -0.891 . . . . 52.11 109.859 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -42.98 99.81 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 122.783 0.433 . . . . 64.33 111.124 -177.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.418 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -67.21 -34.07 76.72 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.303 0.573 . . . . 70.13 111.565 -178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.465 ' O ' HG13 ' A' ' 114' ' ' ILE . 39.6 m-85 -77.55 -32.56 53.95 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 119.53 -0.868 . . . . 72.21 111.538 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 54.5 t -67.0 -49.48 73.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.962 -0.108 . . . . 74.3 110.958 176.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.609 HD22 ' SD ' ' A' ' 192' ' ' MET . 8.4 tt -62.68 -36.6 83.44 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 120.848 0.356 . . . . 54.05 111.235 -176.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.4 p -68.8 -34.42 75.5 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 120.172 -0.611 . . . . 51.12 110.683 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 110' ' ' TYR . 81.5 mt -66.13 -44.99 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.096 0 N-CA-C 109.548 -0.538 . . . . 60.41 109.548 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.518 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 88.7 m -56.54 -43.02 79.48 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 123.9 0.75 . . . . 72.04 111.616 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -73.2 -30.5 63.56 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 118.722 -1.191 . . . . 73.21 109.88 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -65.96 -41.31 91.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.24 -0.436 . . . . 74.13 111.401 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 10.6 pt-20 -73.03 -36.43 66.96 Favored 'General case' 0 C--O 1.195 -1.774 0 C-N-CA 120.492 -0.483 . . . . 55.33 111.23 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 115' ' ' THR . 96.0 mt -66.0 -36.44 83.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.788 0.328 . . . . 73.22 111.797 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.4 p -71.6 -30.91 66.34 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 121.341 0.591 . . . . 62.14 110.49 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.6 t -74.11 -39.59 63.27 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 109.15 -0.685 . . . . 63.43 109.15 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 126' ' ' ILE . 6.2 tt -58.13 -49.6 76.41 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 124.499 1.12 . . . . 63.55 109.04 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.636 ' HD2' HG11 ' A' ' 180' ' ' VAL . 15.4 ptmt -65.36 -31.34 72.41 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 119.946 -0.702 . . . . 44.32 111.362 -178.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -72.79 -40.78 65.64 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.524 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.489 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 72.0 mmtt -70.96 -42.11 70.2 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.506 -0.77 . . . . 71.33 112.114 178.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.52 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.3 pp -69.71 -25.63 28.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.104 -0.639 . . . . 75.54 112.072 -177.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.458 ' N ' HD12 ' A' ' 126' ' ' ILE . 23.9 t70 -70.44 -32.42 69.99 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.926 -0.579 . . . . 53.34 109.803 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.72 -51.9 66.47 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.236 -0.653 . . . . 74.11 109.236 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.52 ' HE1' HG22 ' A' ' 126' ' ' ILE 0.427 3.7 p90 -75.89 -18.7 59.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 115.613 1.709 . . . . 70.4 115.613 177.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -70.1 -26.78 64.14 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.528 -0.916 . . . . 75.41 108.528 170.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.9 tmtt? -85.6 -11.53 53.72 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.751 1.22 . . . . 71.12 110.48 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.414 HG23 ' HA ' ' A' ' 129' ' ' TRP . 71.8 t -83.33 136.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 108.814 -0.81 . . . . 63.22 108.814 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -132.75 -164.31 1.46 Allowed 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.754 -1.202 . . . . 72.31 107.754 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -64.66 107.1 1.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.214 -1.032 . . . . 71.35 108.214 174.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.3 t -108.56 163.41 13.26 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.586 -0.734 . . . . 74.12 110.504 -174.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.03 -13.9 30.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 125.137 1.375 . . . . 63.42 112.327 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -85.53 -0.98 56.56 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 121.562 0.696 . . . . 74.51 110.354 -177.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.34 17.73 Favored Glycine 0 CA--C 1.491 -1.439 0 N-CA-C 109.672 -1.371 . . . . 53.23 109.672 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.532 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 4.1 m -89.6 134.14 34.28 Favored 'General case' 0 N--CA 1.421 -1.918 0 CA-C-N 115.1 -0.55 . . . . 73.11 110.001 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -90.44 162.67 14.98 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 107.007 -1.479 . . . . 64.45 107.007 175.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 31.2 m -67.3 134.99 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 N-CA-C 108.116 -1.068 . . . . 65.42 108.116 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 129' ' ' TRP . 46.9 mm -84.6 92.33 3.15 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.521 -0.918 . . . . 72.5 108.521 -177.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.445 ' O ' ' HA ' ' A' ' 168' ' ' THR . 72.0 mm-40 -106.08 -19.56 13.68 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 113.905 1.076 . . . . 74.23 113.905 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -115.25 157.95 23.02 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 119.957 -0.697 . . . . 72.33 109.271 -176.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.593 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 12.1 tt -70.7 -28.34 33.89 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.74 -0.467 . . . . 73.21 109.74 176.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.437 ' HE3' ' HB2' ' A' ' 166' ' ' ASP . 9.4 mtmp? -88.78 28.1 1.21 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 121.151 0.501 . . . . 53.5 111.85 176.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -89.57 155.75 19.06 Favored 'General case' 0 CA--C 1.472 -2.038 0 N-CA-C 109.025 -0.731 . . . . 75.13 109.025 174.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -46.2 -48.0 17.73 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 125.396 1.479 . . . . 72.2 113.254 -170.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -79.37 -34.31 42.1 Favored 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 120.462 -0.495 . . . . 73.24 111.711 -174.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.568 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -72.0 -46.22 58.05 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.782 -0.645 . . . . 65.51 109.293 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.482 ' O ' HG22 ' A' ' 155' ' ' VAL . 58.2 t30 -59.93 -39.74 86.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.641 -1.163 . . . . 73.21 109.465 -178.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.8 m -62.14 -34.31 76.13 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 116.11 -0.496 . . . . 64.31 112.168 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.489 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 90.2 t90 -78.6 -42.6 28.57 Favored 'General case' 0 CA--C 1.497 -1.077 0 C-N-CA 119.915 -0.714 . . . . 74.35 109.514 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.42 ' HD1' ' O ' ' A' ' 150' ' ' THR . 33.1 m-85 -64.43 -46.02 85.01 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.36 -0.836 . . . . 75.02 112.106 -177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.482 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.4 m -62.11 -39.39 83.7 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 112.57 0.581 . . . . 51.31 112.57 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.41 -35.66 81.59 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.522 0.513 . . . . 62.21 111.102 -179.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -80.9 -3.41 51.28 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.062 1.134 . . . . 73.2 114.062 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.98 -10.82 27.21 Favored Glycine 0 CA--C 1.493 -1.316 0 C-N-CA 119.403 -1.38 . . . . 53.04 112.799 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -71.45 109.59 5.52 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.141 -0.688 . . . . 70.22 109.141 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -79.65 148.74 31.51 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 106.718 -1.586 . . . . 74.4 106.718 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.53 -39.78 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 N-CA-C 112.162 0.43 . . . . 73.14 112.162 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.82 65.7 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.147 0.425 . . . . 65.53 112.147 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.94 -39.36 30.44 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 116.251 -0.431 . . . . 73.3 111.421 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 pp -85.2 132.0 34.35 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.343 0.592 . . . . 63.23 111.564 -175.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.423 ' HB2' ' C ' ' A' ' 86' ' ' CYS . 64.9 t30 -93.01 137.82 32.03 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.407 -0.815 . . . . 55.43 108.862 -176.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.593 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 14.3 t70 -82.21 102.73 11.32 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 113.733 1.012 . . . . 71.03 113.733 -171.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.7 m -120.77 166.24 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-N 114.978 -1.01 . . . . 70.45 108.74 175.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 143' ' ' GLN . 6.9 p -71.17 144.07 50.31 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.746 0.784 . . . . 73.15 111.669 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.86 -39.1 93.02 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 114.183 -1.371 . . . . 54.53 109.899 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -75.88 -26.09 56.74 Favored 'General case' 0 C--N 1.307 -1.264 0 C-N-CA 119.664 -0.815 . . . . 74.33 112.298 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -75.39 -42.66 53.34 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 108.402 -0.962 . . . . 62.32 108.402 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 63.4 tp -57.85 -42.14 83.82 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.457 -0.792 . . . . 64.13 109.721 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.95 85.36 Favored 'General case' 0 CA--C 1.507 -0.681 0 C-N-CA 123.364 0.666 . . . . 53.52 111.158 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.0 m -67.05 -44.21 80.76 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.442 -0.799 . . . . 65.31 110.163 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.64 -38.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.678 -0.692 . . . . 64.33 111.405 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -75.47 -31.03 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.364 -0.934 . . . . 73.12 110.27 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -71.48 -39.4 70.91 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.961 -0.696 . . . . 73.21 111.112 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.52 -28.44 62.86 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.956 -0.698 . . . . 70.33 111.724 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.33 -40.02 37.87 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.653 -0.419 . . . . 75.51 110.411 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . 0.636 HG11 ' HD2' ' A' ' 123' ' ' LYS . 9.5 p -67.97 -23.33 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 119.995 -0.682 . . . . 41.14 110.169 -178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.476 ' HA ' HD11 ' A' ' 186' ' ' ILE . 39.0 p -103.56 13.02 34.26 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.888 -0.596 . . . . 65.45 111.733 177.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -66.26 122.81 18.32 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.153 -1.055 . . . . 63.31 108.153 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -55.71 -50.36 70.53 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 123.548 0.739 . . . . 70.43 112.82 -174.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -70.84 -34.29 71.52 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.65 0.738 . . . . 61.44 109.865 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -49.82 69.38 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.511 -1.222 . . . . 72.33 108.734 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 181' ' ' SER . 78.1 mt -63.87 -38.93 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-O 121.316 0.579 . . . . 74.34 109.705 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 21.2 t80 -60.54 -46.74 89.06 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.294 -0.866 . . . . 75.11 112.01 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.45 HG21 HG13 ' A' ' 74' ' ' ILE . 9.7 tp -76.72 -34.04 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.941 0 C-N-CA 119.335 -0.946 . . . . 75.03 109.838 -178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -67.39 -41.43 84.97 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.678 -0.692 . . . . 75.41 111.739 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -75.35 -28.9 59.75 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.335 -0.946 . . . . 73.41 109.952 -176.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.34 78.87 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.735 -0.666 . . . . 70.24 109.811 175.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.609 ' SD ' HD22 ' A' ' 112' ' ' LEU . 59.0 mtt -65.17 -40.5 94.39 Favored 'General case' 0 CA--C 1.498 -1.032 0 N-CA-C 109.903 -0.406 . . . . 71.1 109.903 175.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -56.14 -39.71 72.69 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.63 0.772 . . . . 73.24 109.979 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -66.93 -46.38 74.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.784 -0.644 . . . . 74.12 109.839 177.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -66.22 -40.54 90.39 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.787 -0.642 . . . . 74.53 110.911 -176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -72.14 -29.24 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 C-N-CA 120.593 -0.443 . . . . 64.15 110.57 -177.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -72.08 -45.58 60.16 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.795 -0.817 . . . . 54.3 108.795 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -61.53 -43.19 99.3 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.406 -1.27 . . . . 64.23 109.591 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -66.97 -35.86 80.92 Favored 'General case' 0 C--O 1.206 -1.207 0 N-CA-C 112.488 0.551 . . . . 74.51 112.488 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 91.0 m -72.77 -35.05 67.34 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.846 -0.741 . . . . 72.4 111.187 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -70.57 -29.59 66.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.786 0.803 . . . . 45.22 110.412 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.17 -39.42 63.23 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.435 -0.802 . . . . 75.55 109.647 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -59.86 -46.93 87.74 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 123.829 0.852 . . . . 72.32 109.847 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 5.5 p -67.76 -32.45 73.05 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.737 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -65.92 -44.4 85.28 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 109.25 -0.648 . . . . 73.31 109.25 174.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -66.46 -35.18 79.64 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 116.108 -0.496 . . . . 74.22 111.518 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.18 -47.8 78.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.792 -0.818 . . . . 73.4 108.792 177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.04 -40.44 94.78 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.908 -0.587 . . . . 75.22 109.761 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.3 ttt -63.65 -40.38 96.72 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.468 -0.787 . . . . 64.33 111.2 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.4 mmt -77.21 -26.67 52.99 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.754 -0.778 . . . . 73.52 112.118 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.83 19.19 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 121.162 0.506 . . . . 53.2 110.637 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -85.99 -43.21 13.35 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 113.409 0.892 . . . . 64.14 113.409 -175.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -96.81 -48.76 5.34 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 109.638 -0.505 . . . . 72.13 109.638 -172.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -79.77 173.85 55.09 Favored Glycine 0 N--CA 1.424 -2.161 0 CA-C-N 115.463 -0.79 . . . . 65.15 113.581 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 8.8 tt -139.57 113.1 6.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 N-CA-C 107.751 -1.203 . . . . 74.42 107.751 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 108.34 0.72 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.649 -0.705 . . . . 63.21 111.504 -176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -88.27 -159.27 34.56 Favored Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.871 -0.604 . . . . 75.14 112.372 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -79.21 86.9 4.95 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.484 0.659 . . . . 52.32 111.206 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -124.29 160.52 27.84 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.414 -0.812 . . . . 74.2 109.852 176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -140.55 -78.77 0.06 OUTLIER Glycine 0 N--CA 1.422 -2.263 0 N-CA-C 108.452 -1.859 . . . . 63.53 108.452 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -162.45 140.04 8.32 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.562 -0.903 . . . . 45.42 108.562 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -99.49 152.81 19.59 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 107.303 -1.369 . . . . 74.32 107.303 176.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 . . . . . 0 C--N 1.312 -1.038 0 CA-C-O 117.78 -1.105 . . . . 62.31 110.378 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.241 0.641 0 CA-C-O 119.822 -0.133 . . . . 53.44 110.878 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.2 m 72.79 141.49 0.06 Allowed 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.346 1.058 . . . . 70.21 111.352 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.84 166.38 26.61 Favored Glycine 0 N--CA 1.424 -2.104 0 C-N-CA 120.373 -0.917 . . . . 74.21 111.091 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.2 tt -97.92 136.89 27.14 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 108.975 -0.75 . . . . 74.32 108.975 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -159.95 140.47 11.96 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 110.142 -0.318 . . . . 71.21 110.142 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 101.03 83.02 1.71 Allowed Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 120.707 -0.759 . . . . 71.23 112.513 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.8 m -115.04 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 107.808 -1.182 . . . . 63.14 107.808 176.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -134.73 101.21 4.85 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.995 -0.548 . . . . 74.25 110.887 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.72 85.07 1.69 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 104.696 -2.335 . . . . 71.42 104.696 174.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -150.86 74.36 1.16 Allowed 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.123 -1.398 . . . . 70.14 108.624 -174.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -89.75 -57.64 2.8 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.17 -0.923 . . . . 44.15 109.258 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.0 mttp 63.55 103.06 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.603 -1.18 . . . . 74.04 110.947 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -80.35 103.01 9.92 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.327 0.584 . . . . 65.51 110.154 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.61 -51.51 69.11 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.09 -1.414 . . . . 53.12 110.555 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m 47.55 81.31 0.04 OUTLIER 'General case' 0 C--O 1.243 0.749 0 N-CA-C 114.937 1.458 . . . . 75.35 114.937 174.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.2 t -113.06 101.15 12.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 108.127 -1.064 . . . . 75.3 108.127 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.9 t -113.62 101.2 12.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-N 115.742 -0.663 . . . . 72.44 109.69 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -107.98 117.71 34.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 107.712 -1.218 . . . . 65.21 107.712 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -146.31 54.22 0.54 Allowed Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 111.179 -0.768 . . . . 44.44 111.179 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.42 99.72 2.05 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 121.555 0.693 . . . . 71.14 110.835 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.6 m -117.1 156.89 26.83 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 106.585 -1.635 . . . . 25.35 106.585 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.9 m -67.65 95.83 0.51 Allowed 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 121.393 0.616 . . . . 63.25 110.133 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.4 m -95.63 14.06 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 124.087 1.898 . . . . 75.55 109.773 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -131.48 107.54 8.96 Favored 'General case' 0 C--N 1.25 -3.751 0 N-CA-C 100.79 -3.781 . . . . 73.43 100.79 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.63 165.94 20.62 Favored 'General case' 0 C--N 1.28 -2.446 0 CA-C-N 115.473 -0.785 . . . . 75.14 111.327 -169.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.6 t -97.51 176.5 5.84 Favored 'General case' 0 N--CA 1.398 -3.071 0 N-CA-C 106.011 -1.848 . . . . 63.44 106.011 177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 31' ' ' ILE . 2.9 mm? -62.41 -35.95 80.85 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 112.822 0.675 . . . . 64.12 112.822 -171.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.2 OUTLIER -77.54 -40.81 41.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.72 -0.844 . . . . 75.45 108.72 -179.222 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' OD2' ' A' ' 32' ' ' ASP . 81.7 mm-40 -62.09 -30.65 71.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 65.2 111.493 -176.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.456 ' HG3' HG13 ' A' ' 111' ' ' VAL . 8.0 tp-100 -72.86 -31.86 65.03 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 121.501 0.667 . . . . 71.44 109.33 178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.479 HD13 ' HE2' ' A' ' 82' ' ' LYS . 76.6 mt -67.46 -36.57 76.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.553 -0.749 . . . . 74.3 110.035 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 29' ' ' GLU . 13.5 m-20 -58.43 -42.94 88.4 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.928 -0.768 . . . . 73.34 108.928 176.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.531 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.0 t90 -65.73 -42.93 90.44 Favored 'General case' 0 N--CA 1.431 -1.401 0 CA-C-N 115.307 -0.86 . . . . 70.24 109.238 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' HB2' HG11 ' A' ' 111' ' ' VAL . 58.1 tp -63.61 -42.18 98.25 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.941 0.4 . . . . 63.52 110.926 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.54 -43.71 89.1 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-N 115.576 -0.738 . . . . 70.13 109.777 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -76.75 -20.31 56.64 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 116.158 -0.474 . . . . 72.23 111.94 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -70.92 -40.07 72.33 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 109.165 -0.68 . . . . 75.43 109.165 174.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 38.4 t80 -76.56 -34.26 58.48 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.179 0.514 . . . . 55.52 109.895 174.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.0 m -92.28 30.06 1.54 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 109.16 -0.682 . . . . 65.22 109.16 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.26 126.27 30.67 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 121.594 0.711 . . . . 55.45 111.95 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -93.05 108.53 20.09 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 115.131 -0.94 . . . . 73.23 110.457 175.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.09 37.86 4.25 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-O 121.856 0.836 . . . . 71.22 110.039 176.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 p -60.23 -27.77 67.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.838 -1.074 . . . . 53.32 112.147 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -64.33 -20.04 65.84 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.934 -0.576 . . . . 62.22 111.753 176.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -102.3 134.11 46.12 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 115.543 -0.753 . . . . 72.03 110.176 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -111.44 100.72 9.25 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 105.003 -2.221 . . . . 71.51 105.003 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.693 HG21 ' HG3' ' A' ' 99' ' ' ARG . 67.7 p -60.97 102.23 0.19 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.053 1.501 . . . . 73.11 115.053 -167.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.0 m -97.64 87.11 3.97 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.061 -0.972 . . . . 72.41 109.215 178.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.7 mttp 62.41 75.22 0.41 Allowed 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 114.108 1.151 . . . . 71.12 114.108 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.593 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 24.1 m0 -79.73 99.43 7.43 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 107.357 -1.349 . . . . 73.02 107.357 165.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 53.7 m-80 -82.79 63.41 6.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 122.189 0.995 . . . . 74.24 111.246 -176.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -78.47 -46.5 19.56 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.455 -1.248 . . . . 64.21 108.59 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.666 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 5.7 p-10 -61.53 -35.28 77.29 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.126 -0.943 . . . . 63.01 110.34 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 18.1 tp10 -70.6 -38.63 74.03 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 115.471 -0.786 . . . . 71.31 110.294 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -74.12 -34.61 63.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.072 0.463 . . . . 64.53 110.329 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.469 HG22 ' HA ' ' A' ' 53' ' ' ASP . 24.6 m -75.41 -17.6 15.86 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.845 0 C-N-CA 120.288 -0.565 . . . . 55.32 111.446 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.666 ' HG3' ' O ' ' A' ' 53' ' ' ASP . 95.4 mttt -61.07 -42.17 97.99 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.825 -0.806 . . . . 74.01 108.825 170.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -69.79 -46.45 65.72 Favored 'General case' 0 CA--C 1.502 -0.871 0 C-N-CA 119.163 -1.015 . . . . 74.02 110.867 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 88.8 mt -75.44 -34.59 60.99 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 114.267 1.21 . . . . 73.22 114.267 -171.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 93.9 mt -133.7 13.93 4.04 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 112.601 0.593 . . . . 65.32 112.601 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.9 m120 67.29 -168.18 0.2 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.414 0.686 . . . . 53.33 110.111 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.79 -13.36 61.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.426 0.631 . . . . 64.05 110.627 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -62.49 -35.24 78.73 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.344 -0.844 . . . . 74.42 112.312 -174.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -104.93 12.91 31.89 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 113.48 0.919 . . . . 54.12 113.48 -175.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.02 111.52 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-O 121.48 0.657 . . . . 55.25 110.717 -178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 117.76 40.98 0.68 Allowed Glycine 0 C--N 1.312 -0.793 0 N-CA-C 107.985 -2.046 . . . . 74.12 107.985 -172.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.405 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 14.9 tt -76.24 -38.19 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 N-CA-C 113.573 0.953 . . . . 75.54 113.573 -168.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -36.31 81.38 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 118.34 -1.344 . . . . 65.42 109.197 -179.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.1 m -62.94 -41.48 99.5 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.193 -0.458 . . . . 72.31 109.942 175.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -64.73 -45.75 85.18 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.244 -0.889 . . . . 62.41 109.618 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 96.9 mt -67.29 -40.07 86.05 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 115.424 -0.807 . . . . 71.21 110.248 -178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.01 -40.53 95.05 Favored 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 123.346 0.404 . . . . 75.11 111.17 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.46 72.51 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 120.563 -0.455 . . . . 43.05 111.853 -177.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.2 mt -77.45 -41.05 29.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 C-N-CA 119.775 -0.77 . . . . 70.11 110.28 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.25 -42.05 93.66 Favored 'General case' 0 C--O 1.193 -1.883 0 CA-C-N 116.116 -0.493 . . . . 63.21 111.134 -178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 21.8 ptmt -61.27 -41.14 96.42 Favored 'General case' 0 CA--C 1.527 0.076 0 N-CA-C 112.231 0.456 . . . . 75.02 112.231 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.38 -36.36 63.55 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 120.994 0.426 . . . . 73.11 110.23 -177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -71.96 -36.45 69.85 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.733 -0.84 . . . . 61.34 108.733 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -57.46 -55.15 38.52 Favored 'General case' 0 C--O 1.216 -0.691 0 C-N-CA 123.896 0.879 . . . . 74.42 109.408 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.41 ' O ' HG23 ' A' ' 84' ' ' VAL . 22.0 ptmt -66.58 -33.26 75.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.248 -0.433 . . . . 75.04 112.08 -174.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.412 HD12 HD21 ' A' ' 179' ' ' LEU . 96.2 mt -82.75 -35.78 26.3 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.381 0.511 . . . . 75.05 112.381 -177.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.479 ' HE2' HD13 ' A' ' 31' ' ' ILE . 36.4 tptt -79.91 -23.95 41.45 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 108.896 -0.779 . . . . 53.54 108.896 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.0 t -65.91 -29.96 70.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.31 0.644 . . . . 64.03 110.649 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' LYS . 94.1 t -58.88 -32.85 48.08 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.887 0.851 . . . . 70.04 109.484 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -84.82 -14.35 48.31 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.954 -1.475 . . . . 73.34 111.478 -177.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 56.2 m -108.34 138.85 43.93 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 121.116 0.484 . . . . 62.35 111.908 -175.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 55.4 m -80.46 122.33 26.86 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 112.276 0.473 . . . . 70.43 112.276 -178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.5 20.4 64.22 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.438 -0.801 . . . . 64.42 113.567 174.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 45.7 t -107.97 142.81 19.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 108.641 -0.874 . . . . 63.53 108.641 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -82.18 142.51 32.13 Favored 'General case' 0 CA--C 1.494 -1.198 0 N-CA-C 107.589 -1.263 . . . . 65.22 107.589 178.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 91' ' ' GLU . 0.4 OUTLIER -94.09 2.49 55.99 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 122.08 0.943 . . . . 73.52 110.411 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 63.7 m -152.9 107.62 2.68 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 107.582 -1.266 . . . . 73.12 107.582 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -77.99 161.33 29.91 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 122.498 2.132 . . . . 62.44 112.613 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.37 -41.79 7.27 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.763 -1.199 . . . . 72.41 107.763 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -88.39 99.18 12.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.664 -0.865 . . . . 74.35 108.664 175.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.44 139.05 51.69 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.106 0 CA-C-N 114.841 -1.072 . . . . 73.01 111.287 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.25 154.7 38.87 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.043 -0.98 . . . . 61.03 112.523 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -119.63 -4.38 10.29 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.232 -0.894 . . . . 74.35 109.382 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.6 mmt180 -136.47 134.36 37.56 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.769 -0.65 . . . . 74.54 111.703 -172.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.9 t -122.49 127.57 75.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 N-CA-C 108.139 -1.059 . . . . 75.44 108.139 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -75.27 157.79 84.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 109.443 -0.577 . . . . 53.11 109.443 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.09 -45.23 40.36 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.74 2.294 . . . . 65.32 111.882 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.88 -36.43 92.13 Favored Glycine 0 C--N 1.313 -0.701 0 CA-C-N 115.026 -0.988 . . . . 61.14 112.274 178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 108' ' ' MET . 72.7 m-20 -70.89 -40.33 72.28 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.174 -0.676 . . . . 73.55 109.174 179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.91 -46.84 86.93 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 123.728 0.811 . . . . 75.43 111.788 -177.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.24 -27.73 30.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-O 121.362 0.601 . . . . 74.42 111.478 -177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.515 ' O ' HG23 ' A' ' 111' ' ' VAL . 36.5 m -73.08 -40.04 65.36 Favored 'General case' 0 N--CA 1.42 -1.934 0 CA-C-N 115.462 -0.79 . . . . 63.41 109.279 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 104' ' ' ASP . 88.9 mtp -65.29 -35.51 81.24 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 116.464 -0.334 . . . . 72.13 110.949 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 95.6 mt -58.1 -50.29 74.0 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 123.671 0.607 . . . . 72.24 109.525 176.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -63.6 -35.85 81.88 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.948 -0.569 . . . . 72.33 111.68 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.531 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 90.6 t -66.73 -40.3 85.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 CA-C-N 116.496 -0.32 . . . . 73.2 111.223 177.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.1 mt -65.77 -33.77 76.63 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.674 0.273 . . . . 75.1 111.688 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.464 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 12.7 p -74.93 -38.36 61.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 119.786 -0.766 . . . . 44.32 110.693 176.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.3 mm -64.51 -43.12 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 122.528 0.331 . . . . 64.22 111.011 176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 17.1 p -67.34 -37.1 82.72 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 121.002 -0.279 . . . . 63.44 110.937 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -62.74 -36.77 84.12 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.177 -0.675 . . . . 72.51 109.177 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 113' ' ' SER . 76.8 mtt180 -67.0 -38.49 86.1 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.025 -0.534 . . . . 75.43 111.834 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -35.21 63.87 Favored 'General case' 0 C--O 1.196 -1.739 0 C-N-CA 118.665 -1.214 . . . . 71.24 110.242 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.405 ' HG ' HG13 ' A' ' 176' ' ' VAL . 36.2 tp -58.74 -50.55 73.5 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 124.013 0.925 . . . . 74.42 110.311 178.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 11.2 p -67.57 -37.26 82.37 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.785 -0.643 . . . . 74.12 111.024 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 50.9 m -68.05 -35.19 77.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.052 -0.351 . . . . 75.54 110.052 178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 176' ' ' VAL . 8.4 tt -64.32 -43.81 93.53 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 123.77 0.828 . . . . 64.01 109.072 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.55 ' HB2' HG11 ' A' ' 176' ' ' VAL . 59.0 tttp -69.03 -39.09 79.43 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.619 -0.432 . . . . 73.21 111.193 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -63.87 -35.03 79.3 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-O 120.993 0.425 . . . . 73.21 111.83 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.535 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 74.6 mmtt -77.4 -42.4 36.44 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 115.994 -0.548 . . . . 73.32 110.779 176.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 13.0 mt -59.62 -46.45 93.18 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.501 0 O-C-N 123.363 0.415 . . . . 73.44 111.299 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.5 m-20 -64.18 -21.57 66.61 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 112.361 0.504 . . . . 52.43 112.361 -178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -77.07 -51.06 11.7 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.505 -0.924 . . . . 74.31 108.505 178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.535 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.396 1.9 p90 -75.09 -18.65 60.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 114.39 1.256 . . . . 73.14 114.39 176.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -25.78 63.96 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 123.325 0.65 . . . . 75.14 110.371 170.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 74.5 mmtt -74.1 -24.57 59.48 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 108.869 -0.789 . . . . 41.44 108.869 173.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -71.37 142.09 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 CA-C-N 114.92 -1.036 . . . . 74.41 109.186 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -129.77 178.79 6.24 Favored 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 107.234 -1.395 . . . . 75.45 107.234 -175.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.74 107.65 4.66 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.178 -1.045 . . . . 72.33 108.178 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -115.6 143.61 45.1 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.592 -0.731 . . . . 63.2 109.982 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -20.46 57.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.489 1.115 . . . . 71.12 112.596 -177.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.83 -26.69 68.73 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.106 -0.952 . . . . 63.42 111.102 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 124.78 3.32 7.73 Favored Glycine 0 CA--C 1.488 -1.614 0 C-N-CA 120.41 -0.9 . . . . 65.45 113.481 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.0 m -95.48 121.22 36.94 Favored 'General case' 0 C--N 1.283 -2.326 0 N-CA-C 107.335 -1.357 . . . . 75.34 107.335 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -96.91 -172.72 2.52 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.435 -0.58 . . . . 72.42 109.435 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.6 m -76.1 125.2 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.884 0 C-N-CA 119.441 -0.904 . . . . 64.21 109.144 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.5 mt -95.52 90.63 2.63 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.976 0 N-CA-C 106.644 -1.613 . . . . 74.31 106.644 -176.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -117.25 -10.48 10.78 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.397 -1.274 . . . . 62.42 112.418 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -113.69 146.31 40.02 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.408 0.623 . . . . 73.01 110.91 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.54 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.1 tt -61.68 -25.31 36.55 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.194 -0.912 . . . . 74.54 110.764 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.76 24.82 8.61 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.733 0.778 . . . . 51.24 112.7 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -78.56 154.6 30.25 Favored 'General case' 0 N--CA 1.431 -1.375 0 N-CA-C 106.255 -1.757 . . . . 71.04 106.255 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -54.34 -37.16 64.58 Favored 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 123.23 0.612 . . . . 74.0 112.518 -171.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -78.26 -37.64 44.65 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 121.015 -0.274 . . . . 73.23 111.198 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -71.73 -43.61 65.55 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 109.106 -0.701 . . . . 71.32 109.106 -179.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 155' ' ' VAL . 61.0 t30 -62.39 -33.82 75.51 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.018 -0.992 . . . . 72.25 109.882 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 90.3 m -61.48 -39.78 92.17 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.048 0.452 . . . . 63.02 110.808 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.479 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 88.8 t90 -74.34 -41.19 61.5 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 109.892 -0.41 . . . . 74.13 109.892 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.451 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.5 m-85 -62.72 -46.78 86.53 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.651 -0.704 . . . . 70.23 112.478 -178.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 151' ' ' ASN . 21.9 m -63.92 -35.29 72.87 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 C-N-CA 120.347 -0.541 . . . . 44.14 112.137 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.38 87.01 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.744 -0.662 . . . . 63.04 110.924 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -85.21 6.98 23.65 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.363 0.875 . . . . 72.42 113.363 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.18 -1.47 60.77 Favored Glycine 0 N--CA 1.436 -1.328 0 C-N-CA 120.463 -0.875 . . . . 73.43 113.725 174.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.456 ' HA ' ' HG3' ' A' ' 28' ' ' LYS . 50.7 m-85 -81.49 100.94 9.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.237 -1.394 . . . . 75.23 107.237 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -74.61 158.49 33.58 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 109.363 -0.606 . . . . 60.41 109.363 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.62 -30.51 37.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 123.029 0.532 . . . . 72.2 111.932 -175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.17 -8.82 58.96 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.901 0.381 . . . . 63.44 111.769 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -96.1 -39.42 9.73 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 112.409 0.522 . . . . 61.53 112.409 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.506 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.3 pt? -74.32 149.52 40.6 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 119.486 -0.886 . . . . 74.54 110.938 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 60.7 t30 -115.94 141.54 47.97 Favored 'General case' 0 C--N 1.287 -2.149 0 N-CA-C 106.689 -1.597 . . . . 74.14 106.689 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -74.31 110.16 8.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 122.294 1.045 . . . . 51.01 113.247 -173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 29.4 t -129.28 153.14 38.25 Favored 'Isoleucine or valine' 0 C--O 1.257 1.492 0 N-CA-C 106.422 -1.696 . . . . 73.14 106.422 176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 6.8 p -83.35 145.3 29.12 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-O 121.382 0.61 . . . . 74.34 111.921 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 150' ' ' THR . 8.7 mp -63.91 -26.26 68.52 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 115.526 -0.761 . . . . 74.34 112.189 -179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -26.41 60.97 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.004 -0.679 . . . . 72.43 110.716 178.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -83.87 -42.5 16.32 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 115.35 -0.841 . . . . 55.22 108.913 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 176' ' ' VAL . 93.7 mt -61.24 -45.94 92.46 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.943 -0.571 . . . . 45.31 110.672 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.07 -38.58 86.75 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.884 0.327 . . . . 62.44 111.884 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.0 p -72.16 -35.23 68.98 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 120.708 -0.397 . . . . 72.11 111.774 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.5 t -69.52 -44.78 79.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.039 0.447 . . . . 74.44 110.235 176.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.55 HG11 ' HB2' ' A' ' 123' ' ' LYS . 98.4 t -64.47 -40.65 89.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.901 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -61.79 -38.65 88.87 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.419 -0.355 . . . . 62.43 110.657 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -67.49 -43.86 79.91 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.107 -0.497 . . . . 75.1 109.924 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.412 HD21 HD12 ' A' ' 81' ' ' LEU . 79.1 mt -67.74 -35.54 78.93 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 113.144 0.794 . . . . 73.13 113.144 -179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 8.9 p -81.54 -18.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 C-N-CA 120.063 -0.655 . . . . 74.33 111.061 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 13.9 m -101.24 -0.38 35.94 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 121.429 0.633 . . . . 61.33 110.186 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 185' ' ' MET . 65.7 t-80 -63.52 130.57 44.93 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.892 1.277 . . . . 74.33 111.146 -174.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -54.83 -47.98 73.43 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.917 1.287 . . . . 63.42 113.63 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -80.27 -31.35 38.38 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 119.565 -0.854 . . . . 72.12 109.984 -172.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . 0.455 ' HB3' ' HB3' ' A' ' 182' ' ' HIS . 55.3 tpp -65.38 -45.15 85.19 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.121 -0.945 . . . . 74.15 110.445 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.07 -26.34 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 C-N-CA 120.963 -0.295 . . . . 74.02 110.75 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -65.1 -53.56 43.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.722 -0.672 . . . . 72.1 109.603 174.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 192' ' ' MET . 23.8 mm -65.19 -38.23 82.14 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 CA-C-N 116.161 -0.472 . . . . 50.2 110.426 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -66.28 -39.73 89.6 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.444 -0.343 . . . . 73.52 111.577 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 194' ' ' GLN . 14.5 t70 -71.85 -38.95 70.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 120.031 -0.668 . . . . 75.55 109.689 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -64.9 -42.62 94.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.802 -0.635 . . . . 64.01 109.548 178.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.429 ' HB2' ' O ' ' A' ' 188' ' ' ILE . 0.0 OUTLIER -61.85 -43.47 98.79 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.307 -0.86 . . . . 71.21 109.982 176.632 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.56 -39.41 80.2 Favored 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 123.123 0.569 . . . . 64.2 110.942 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 190' ' ' ASP . 70.7 mt-30 -74.85 -40.8 60.8 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 109.551 -0.537 . . . . 75.41 109.551 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.02 -40.73 87.3 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.254 -0.885 . . . . 65.45 110.749 -176.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.22 -33.01 56.03 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.885 0 C-N-CA 120.907 -0.317 . . . . 63.32 110.769 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -67.28 -42.81 83.19 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 109.378 -0.601 . . . . 73.05 109.378 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 202' ' ' GLU . 58.9 mtpt -66.72 -41.8 87.34 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.398 -0.819 . . . . 60.2 110.556 177.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . 0.485 ' O ' ' HG2' ' A' ' 203' ' ' GLU . 14.0 m0 -66.11 -38.63 88.69 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 112.862 0.69 . . . . 74.1 112.862 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.7 p -68.18 -31.15 70.49 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.85 -0.74 . . . . 73.32 110.334 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -69.23 -40.82 77.72 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.36 -0.836 . . . . 74.01 110.05 174.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 198' ' ' LYS . 74.0 mt-10 -68.81 -36.34 78.1 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 116.737 -0.21 . . . . 72.42 111.112 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 199' ' ' TRP . 21.1 mm-40 -59.53 -51.32 70.34 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.351 -0.611 . . . . 72.21 109.351 175.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 38.4 t -63.77 -39.04 93.3 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.603 -0.726 . . . . 62.2 110.014 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -64.02 -46.1 85.97 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.85 -0.614 . . . . 62.43 110.177 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 38.5 ptt180 -75.57 -29.19 59.25 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 120.248 -0.581 . . . . 74.43 111.576 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.58 -39.68 64.46 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.489 -0.484 . . . . 70.12 111.0 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.96 84.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.603 -0.517 . . . . 73.35 109.603 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.4 ttt -61.17 -39.68 91.03 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.296 -0.866 . . . . 71.52 110.784 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . 0.579 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 22.1 ttt -71.01 -39.46 72.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.855 -0.611 . . . . 72.43 110.153 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.9 -38.6 79.69 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 116.119 -0.491 . . . . 70.02 110.576 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -23.32 64.22 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 75.44 111.396 177.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -70.95 -46.27 62.71 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 109.653 -0.499 . . . . 74.53 109.653 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 131.41 -30.66 3.26 Favored Glycine 0 CA--C 1.502 -0.767 0 C-N-CA 120.653 -0.784 . . . . 72.23 111.706 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . 0.579 ' O ' ' HG2' ' A' ' 210' ' ' MET . 2.5 mp -98.34 117.35 43.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 N-CA-C 107.748 -1.204 . . . . 72.43 107.748 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 28.1 t -103.18 166.33 10.5 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.503 -0.925 . . . . 75.22 108.503 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -155.13 173.74 33.38 Favored Glycine 0 N--CA 1.427 -1.911 0 N-CA-C 110.906 -0.878 . . . . 74.01 110.906 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -137.56 142.47 41.36 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 109.927 -0.397 . . . . 72.22 109.927 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -152.5 103.9 2.86 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.058 0.456 . . . . 72.14 110.78 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -123.67 147.75 16.67 Favored Glycine 0 C--N 1.288 -2.104 0 N-CA-C 107.298 -2.321 . . . . 73.3 107.298 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.84 106.53 8.57 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 118.386 1.093 . . . . 70.21 112.231 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -85.56 -29.81 23.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 105.243 -2.132 . . . . 63.1 105.243 168.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 N--CA 1.431 -1.419 0 N-CA-C 104.734 -2.321 . . . . 75.24 104.734 173.539 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.438 -1.069 0 N-CA-C 109.552 -0.536 . . . . 54.44 109.552 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -82.85 161.93 21.77 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 116.076 -0.511 . . . . 71.25 110.866 -177.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.25 171.04 33.97 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.126 -1.19 . . . . 52.45 110.126 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.96 118.99 2.31 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 N-CA-C 108.223 -1.028 . . . . 74.25 108.223 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -103.32 113.24 26.58 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 104.689 -2.337 . . . . 64.11 104.689 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -111.41 41.36 2.26 Favored Glycine 0 N--CA 1.432 -1.574 0 C-N-CA 119.704 -1.236 . . . . 54.31 115.116 -171.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.1 t -73.97 97.2 2.78 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 107.593 -1.262 . . . . 72.14 107.593 172.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.9 t -108.74 123.11 48.49 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-O 121.758 0.79 . . . . 63.43 111.451 -174.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -115.01 140.24 49.21 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 106.618 -1.623 . . . . 73.11 106.618 174.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.18 165.72 22.14 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 120.16 -0.616 . . . . 64.5 110.124 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -46.04 -57.65 4.26 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 115.977 1.843 . . . . 62.23 115.977 -170.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 61.87 173.36 0.12 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.266 0.839 . . . . 71.32 113.266 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.05 138.07 0.19 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.2 1.4 . . . . 73.31 107.655 170.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.97 -56.16 3.83 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.477 -0.934 . . . . 62.34 108.477 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -168.44 120.5 0.82 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.305 -1.369 . . . . 72.45 107.305 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.9 t -84.19 97.99 5.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 108.085 -1.079 . . . . 73.33 108.085 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.7 t -82.14 137.32 21.34 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 CA-C-N 115.625 -0.716 . . . . 63.11 109.534 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -134.27 147.03 50.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 108.796 -0.816 . . . . 63.22 108.796 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.461 ' H ' ' HA3' ' A' ' 220' ' ' GLY . . . 63.97 49.21 69.0 Favored Glycine 0 N--CA 1.45 -0.426 0 O-C-N 123.866 0.729 . . . . 61.21 113.014 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.6 102.98 3.89 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.14 0.495 . . . . 63.55 110.646 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.7 t -166.68 171.8 11.22 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 108.503 -0.925 . . . . 72.12 108.503 177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -83.34 88.01 6.96 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-O 121.297 0.57 . . . . 55.04 109.67 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.41 ' O ' ' HB3' ' A' ' 24' ' ' GLU . 48.4 t -83.23 106.78 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 107.525 -1.287 . . . . 61.41 107.525 175.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' VAL . 34.4 tt0 75.29 126.01 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 O-C-N 124.903 1.377 . . . . 71.13 110.886 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.62 174.99 3.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 115.925 -0.58 . . . . 75.3 110.459 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 6.7 m -73.35 166.5 23.07 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.81 -0.811 . . . . 74.24 108.81 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -66.46 -23.77 66.33 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 116.436 -0.347 . . . . 71.02 111.476 -174.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HD3' ' CD2' ' A' ' 159' ' ' PHE . 27.6 tptp -75.8 -47.41 25.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 108.416 -0.957 . . . . 73.23 108.416 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.41 -40.58 97.0 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.073 -1.421 . . . . 75.41 110.788 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.85 -40.66 75.65 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.454 0.645 . . . . 75.54 110.316 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -70.45 -30.66 43.78 Favored 'Isoleucine or valine' 0 C--O 1.26 1.654 0 CA-C-O 121.846 0.831 . . . . 74.31 111.064 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 54.5 m-20 -77.28 -32.08 55.28 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 120.016 -0.674 . . . . 74.32 111.225 174.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -64.98 -44.66 88.57 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 123.557 0.536 . . . . 72.41 110.439 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 112' ' ' LEU . 4.4 tt -55.92 -49.87 72.28 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.374 -0.602 . . . . 53.22 109.374 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.59 -35.65 75.51 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.666 -0.697 . . . . 71.34 110.822 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -70.99 -32.13 68.86 Favored 'General case' 0 C--O 1.201 -1.481 0 CA-C-N 116.335 -0.393 . . . . 71.2 110.571 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 37' ' ' ARG . 0.5 OUTLIER -65.21 -34.45 78.39 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.301 -0.999 . . . . 75.14 108.301 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 41.0 t80 -75.68 -37.92 59.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 120.56 -0.456 . . . . 73.41 111.262 172.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.404 ' HB2' ' CD2' ' A' ' 79' ' ' HIS . 11.9 t -88.5 23.15 2.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.312 1.045 . . . . 62.13 111.817 -174.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -132.54 125.99 31.83 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 107.354 -1.35 . . . . 52.4 107.354 174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.548 ' H ' ' HB3' ' A' ' 95' ' ' HIS . 1.9 p-10 -95.57 155.9 16.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.641 -0.824 . . . . 64.53 109.776 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' A' ' 99' ' ' ARG . 1.0 OUTLIER -129.97 41.77 3.37 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.009 -0.996 . . . . 75.43 111.053 -177.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -67.27 -17.42 64.78 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.357 1.075 . . . . 72.31 108.726 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.09 -17.48 60.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.536 -1.211 . . . . 72.05 110.639 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -89.26 150.68 22.51 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.275 -0.875 . . . . 74.3 110.937 -178.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -92.27 117.26 29.71 Favored 'General case' 0 C--N 1.292 -1.896 0 N-CA-C 106.785 -1.561 . . . . 72.44 106.785 173.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.529 HG21 ' HG3' ' A' ' 99' ' ' ARG . 34.7 p -111.99 44.7 1.36 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.594 -0.842 . . . . 71.11 111.392 -173.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.9 m -65.17 89.58 0.08 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.36 -0.836 . . . . 74.32 112.11 -176.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.9 tttt 53.13 68.83 0.78 Allowed 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.497 1.519 . . . . 74.33 112.931 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 43.7 m0 -65.84 116.63 7.21 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.213 -0.903 . . . . 70.12 109.34 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.27 63.13 7.62 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.624 -1.25 . . . . 74.2 107.624 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.519 ' O ' HG22 ' A' ' 56' ' ' VAL . 17.0 m -78.57 -50.76 10.99 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 115.244 -0.889 . . . . 74.31 109.28 -178.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -36.21 73.92 Favored 'General case' 0 C--O 1.191 -1.989 0 O-C-N 124.065 0.853 . . . . 53.41 109.145 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -72.82 -36.22 67.47 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 115.136 -0.938 . . . . 61.25 110.782 -175.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.88 -41.78 67.62 Favored 'General case' 0 C--N 1.31 -1.134 0 N-CA-C 108.634 -0.876 . . . . 74.31 108.634 -179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 52' ' ' THR . 22.1 m -76.95 -30.35 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.973 0 C-N-CA 119.929 -0.709 . . . . 65.51 111.468 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.418 ' HD3' ' C ' ' A' ' 57' ' ' LYS . 12.2 tmtt? -66.58 -36.78 83.48 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.246 0.546 . . . . 74.3 109.859 174.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.96 -32.63 74.0 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-O 121.687 0.756 . . . . 71.41 109.871 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -85.83 -36.48 20.0 Favored 'General case' 0 CA--C 1.576 1.955 0 CA-C-N 115.433 -0.803 . . . . 60.25 112.104 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 23.8 mt -127.19 18.36 7.07 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 115.83 1.789 . . . . 41.23 115.83 -169.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.0 m120 69.39 -169.6 0.18 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.056 0.542 . . . . 73.34 111.482 177.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.411 ' O ' HG22 ' A' ' 65' ' ' VAL . 13.0 pt-20 -61.09 -6.69 2.09 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.583 1.153 . . . . 73.31 113.328 -177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -77.12 -17.23 58.79 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.998 -0.439 . . . . 75.3 111.399 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -98.12 13.49 30.91 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.468 0.914 . . . . 53.23 113.468 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 62' ' ' GLU . 27.0 m -78.1 130.45 36.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 121.579 -0.701 . . . . 70.32 110.417 177.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.75 32.3 37.47 Favored Glycine 0 C--N 1.307 -1.056 0 CA-C-N 115.846 -0.615 . . . . 41.45 112.409 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 64' ' ' ALA . 9.3 mm -66.59 -34.59 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 112.712 0.634 . . . . 74.34 112.712 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.24 -42.73 99.58 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.455 -0.498 . . . . 73.11 110.953 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.1 p -77.56 -29.73 52.31 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-O 120.989 0.423 . . . . 43.11 110.81 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -63.36 -48.16 79.1 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.309 -0.626 . . . . 73.03 109.309 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 HG23 ' A' ' 67' ' ' ILE . 6.9 mp -65.23 -38.07 89.24 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 115.256 -0.884 . . . . 74.22 110.767 179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.5 mp -61.49 -45.69 93.17 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 123.29 0.369 . . . . 71.42 111.257 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.4 -33.83 74.93 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 112.162 0.431 . . . . 71.52 112.162 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -77.86 -40.83 27.5 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 C-N-CA 119.325 -0.95 . . . . 62.32 110.455 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -34.91 74.96 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 116.137 -0.483 . . . . 73.24 111.729 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.0 ptmm? -61.35 -43.86 98.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 120.745 -0.382 . . . . 74.22 110.68 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.24 -39.68 82.22 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.766 -0.374 . . . . 64.15 111.162 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -68.01 -42.05 81.27 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.736 -0.666 . . . . 71.04 110.539 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.404 ' CD2' ' HB2' ' A' ' 39' ' ' SER . 56.4 t-80 -62.18 -48.22 81.03 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.384 -0.598 . . . . 64.1 109.384 179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -64.26 -36.78 85.22 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.678 -1.146 . . . . 74.34 111.517 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 175' ' ' VAL . 95.0 mt -82.95 -38.65 22.47 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 112.617 0.599 . . . . 72.55 112.617 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 31.1 ttpt -71.8 -20.58 61.83 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 122.845 0.458 . . . . 71.15 111.292 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.8 p -49.27 -31.93 9.84 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 124.577 1.151 . . . . 74.11 112.968 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.7 p -84.56 -21.55 8.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 N-CA-C 111.914 0.338 . . . . 74.53 111.914 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 60.1 tp -89.91 -27.32 19.93 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 122.002 -0.436 . . . . 73.31 111.847 -174.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 87.9 m -101.07 132.24 46.61 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.178 -1.045 . . . . 71.12 108.178 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.6 t -74.77 131.99 41.24 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.796 -0.762 . . . . 65.34 110.798 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.57 8.7 59.43 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.713 -0.676 . . . . 53.24 113.43 177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 46.7 t -106.3 117.93 52.98 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.719 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -85.79 149.21 25.43 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.031 -1.1 . . . . 64.12 108.031 176.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.88 18.94 3.79 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.655 0.741 . . . . 64.2 111.876 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 51.0 m -145.5 100.44 4.41 Favored Pre-proline 0 C--N 1.297 -1.696 0 N-CA-C 109.42 -0.585 . . . . 51.5 109.42 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -81.43 152.2 17.76 Favored 'Trans proline' 0 N--CA 1.443 -1.485 0 C-N-CA 122.165 1.91 . . . . 73.44 112.442 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.61 -33.71 9.79 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.975 -1.12 . . . . 75.04 107.975 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 41' ' ' ASP . 29.5 m80 -92.43 107.21 19.04 Favored 'General case' 0 N--CA 1.414 -2.27 0 N-CA-C 105.158 -2.164 . . . . 75.42 105.158 174.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 97.3 t -122.02 124.54 71.49 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 O-C-N 122.22 -0.3 . . . . 74.33 110.24 177.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.11 123.74 22.35 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 109.84 -0.43 . . . . 74.32 109.84 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.08 -4.39 24.6 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.219 0.533 . . . . 63.03 111.376 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 32.5 mmt180 -138.32 136.77 36.75 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 123.484 0.714 . . . . 75.34 109.254 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.9 t -113.32 125.62 70.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.291 -1.003 . . . . 72.1 108.291 176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.2 m -73.7 145.96 85.12 Favored Pre-proline 0 C--N 1.308 -1.213 0 N-CA-C 109.462 -0.57 . . . . 73.34 109.462 -177.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -48.25 -43.87 30.48 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.4 2.733 . . . . 63.15 113.338 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.19 -36.06 89.44 Favored Glycine 0 C--N 1.31 -0.88 0 CA-C-N 115.427 -0.806 . . . . 41.12 112.148 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -74.93 -38.21 61.84 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 110.296 -0.261 . . . . 63.53 110.296 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.34 -47.94 80.27 Favored 'General case' 0 C--N 1.314 -0.961 0 O-C-N 123.8 0.688 . . . . 63.55 111.504 -177.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.6 pt -69.66 -34.47 61.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 C-N-CA 120.551 -0.459 . . . . 71.04 110.953 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.525 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.8 m -69.96 -45.37 67.57 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 115.739 -0.664 . . . . 74.45 110.247 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.512 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -65.69 -34.87 79.22 Favored 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 122.157 0.183 . . . . 65.22 111.004 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 192' ' ' MET . 83.3 mt -60.39 -45.44 93.54 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.097 0.475 . . . . 73.13 109.91 175.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 17.1 m-30 -67.59 -36.37 80.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.129 -0.487 . . . . 73.33 110.478 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 107' ' ' SER . 80.2 t -62.88 -38.0 80.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 CA-C-N 116.125 -0.489 . . . . 53.24 110.347 176.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 108' ' ' MET . 96.6 mt -60.49 -39.3 87.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.813 0.339 . . . . 61.22 111.044 177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.0 t -71.41 -39.27 71.21 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 116.219 -0.446 . . . . 55.22 111.483 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.657 ' O ' ' HG2' ' A' ' 117' ' ' ARG . 7.1 tt -72.91 -44.95 56.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 119.66 -0.816 . . . . 45.24 110.277 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 61.4 m -62.7 -30.99 71.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.315 0.579 . . . . 62.12 111.304 -175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -79.56 -24.84 41.85 Favored 'General case' 0 N--CA 1.421 -1.887 0 C-N-CA 119.821 -0.752 . . . . 60.11 110.17 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 114' ' ' ILE . 17.6 ptt180 -76.46 -39.55 53.0 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 119.94 -0.704 . . . . 74.53 110.27 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.439 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.283 4.3 pm0 -74.28 -25.27 59.5 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 118.063 -1.455 . . . . 64.1 111.234 175.29 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 42.6 tp -65.26 -39.13 92.23 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.953 -0.758 . . . . 52.52 108.953 175.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.7 m -70.78 -37.76 73.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.438 -0.801 . . . . 64.24 111.119 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 24.4 p -75.36 -31.98 60.71 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.897 0.379 . . . . 53.34 110.072 178.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.432 HD21 HD11 ' A' ' 172' ' ' LEU . 6.2 tt -60.45 -47.23 87.04 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 108.749 -0.834 . . . . 54.02 108.749 172.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -61.67 -41.56 97.71 Favored 'General case' 0 C--O 1.205 -1.241 0 N-CA-C 108.985 -0.746 . . . . 72.0 108.985 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.476 ' O ' ' HG3' ' A' ' 128' ' ' GLU . 8.6 t-20 -59.78 -49.08 79.13 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.374 0.421 . . . . 60.31 111.724 176.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 22.5 mmtm -66.08 -40.57 90.93 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.065 -0.516 . . . . 73.13 111.254 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.463 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 51.6 mt -70.8 -36.98 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 115.535 -0.757 . . . . 65.05 110.59 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.21 -37.19 86.24 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.958 -0.756 . . . . 72.54 108.958 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 132' ' ' VAL . 49.5 mt-10 -63.78 -55.3 24.16 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.271 -0.877 . . . . 70.53 111.052 175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 126' ' ' ILE 0.445 1.4 p90 -77.6 -19.82 54.94 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 115.537 1.68 . . . . 75.33 115.537 -176.289 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -75.59 -22.07 57.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.597 0.713 . . . . 74.34 109.565 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -88.19 -10.67 49.11 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.033 -0.985 . . . . 72.44 108.424 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 128' ' ' GLU . 75.8 t -81.14 146.14 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 107.404 -1.332 . . . . 73.52 107.404 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' HA ' HG12 ' A' ' 141' ' ' VAL . 13.6 ptpt -132.77 -169.17 2.2 Favored 'General case' 0 C--N 1.276 -2.597 0 CA-C-N 115.844 -0.616 . . . . 72.33 109.615 -171.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.75 91.18 0.62 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.21 -0.663 . . . . 70.22 109.21 177.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 44.0 t -90.12 164.81 14.32 Favored 'General case' 0 N--CA 1.423 -1.786 0 CA-C-N 115.345 -0.843 . . . . 62.3 110.83 -176.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.75 -17.75 61.48 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.091 1.356 . . . . 73.13 111.271 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.65 -10.2 59.21 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.63 -1.168 . . . . 61.2 109.924 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 89.77 27.36 22.04 Favored Glycine 0 N--CA 1.439 -1.164 0 N-CA-C 110.837 -0.905 . . . . 74.3 110.837 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 3.2 m -78.72 138.6 38.33 Favored 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 109.187 -0.672 . . . . 74.34 109.187 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -90.16 151.25 21.66 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.056 -1.091 . . . . 74.31 108.056 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 143' ' ' GLN . 15.0 m -72.28 131.59 34.51 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 108.727 -0.842 . . . . 62.42 108.727 172.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.6 tp -80.0 91.66 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.753 0 CA-C-O 123.085 1.422 . . . . 71.21 111.183 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.501 ' HG2' HG23 ' A' ' 141' ' ' VAL . 13.7 mm100 -102.49 -28.23 12.31 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.932 -1.031 . . . . 73.42 112.209 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.419 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.5 t-20 -133.16 141.94 48.38 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.324 -1.362 . . . . 71.3 107.324 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.7 tp -68.07 -4.62 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 124.656 1.182 . . . . 73.15 113.615 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -98.23 30.98 2.92 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.277 -0.889 . . . . 73.32 111.328 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -85.05 155.19 21.64 Favored 'General case' 0 C--N 1.307 -1.257 0 O-C-N 121.906 -0.496 . . . . 74.4 109.701 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.7 -38.29 60.41 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.269 1.028 . . . . 75.52 110.906 -178.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -70.4 -41.28 73.2 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.18 -0.463 . . . . 63.44 110.969 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 6.7 p -74.67 -37.86 62.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 C-N-CA 119.971 -0.691 . . . . 63.24 110.26 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -60.2 -35.53 75.62 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 116.032 -0.531 . . . . 74.12 110.207 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.9 m -62.61 -41.24 98.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.925 -0.31 . . . . 75.04 110.847 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -72.81 -41.46 64.88 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.155 0.502 . . . . 73.33 109.828 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 14.3 m-85 -62.53 -50.22 72.22 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.133 -0.939 . . . . 64.51 111.938 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.3 t -64.68 -31.75 55.03 Favored 'Isoleucine or valine' 0 C--O 1.247 0.96 0 CA-C-O 120.763 0.316 . . . . 75.5 111.074 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.75 -35.91 79.59 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-O 121.553 0.692 . . . . 72.41 110.662 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -84.39 -10.31 57.66 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 113.22 0.822 . . . . 70.14 113.22 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.29 -6.81 21.11 Favored Glycine 0 C--N 1.313 -0.713 0 C-N-CA 119.749 -1.215 . . . . 54.44 113.354 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.554 ' CD2' ' HD3' ' A' ' 28' ' ' LYS . 26.4 m-85 -79.18 100.26 7.38 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 106.92 -1.511 . . . . 75.31 106.92 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 163' ' ' GLU . 27.8 ttmt -81.6 163.42 22.59 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 108.658 -0.867 . . . . 70.23 108.658 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 57.9 t -58.12 -38.46 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 113.591 0.96 . . . . 63.24 113.591 -171.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.61 8.4 31.56 Favored 'General case' 0 C--N 1.306 -1.3 0 O-C-N 122.018 -0.426 . . . . 54.34 111.399 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.486 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 54.0 mm-40 -101.21 -39.23 7.75 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 123.447 0.699 . . . . 62.44 111.118 -178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.481 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.6 pt? -83.01 163.52 20.93 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 119.059 -1.056 . . . . 73.0 109.525 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -122.77 146.85 47.15 Favored 'General case' 0 C--N 1.278 -2.526 0 N-CA-C 106.02 -1.844 . . . . 74.32 106.02 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 1.0 OUTLIER -79.6 145.33 33.15 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 119.558 -0.857 . . . . 75.3 110.152 -175.66 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 12.4 p -164.38 155.29 2.03 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 N-CA-C 107.93 -1.137 . . . . 74.15 107.93 -176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 70.6 p -76.73 145.56 38.56 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 120.937 0.398 . . . . 74.24 110.422 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.35 -23.68 65.63 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 116.21 -0.45 . . . . 72.2 111.095 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -65.51 -42.87 91.6 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.855 -0.611 . . . . 74.44 109.421 175.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -75.19 -34.97 61.59 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.201 -0.666 . . . . 75.22 109.201 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 122' ' ' LEU . 1.4 tm? -65.27 -43.17 92.1 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.497 -0.774 . . . . 73.31 109.261 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . 0.439 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -63.59 -32.43 73.9 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 120.926 0.394 . . . . 72.1 110.814 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 40.6 m -69.42 -45.07 70.05 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.461 -0.791 . . . . 70.34 110.993 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 81' ' ' LEU . 11.4 p -70.26 -36.04 65.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 119.978 -0.689 . . . . 72.52 111.5 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 173' ' ' ALA . 11.5 p -75.41 -25.16 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.261 -0.576 . . . . 71.44 109.468 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -64.96 -49.23 71.12 Favored 'General case' 0 CA--C 1.501 -0.936 0 N-CA-C 109.307 -0.627 . . . . 73.23 109.307 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.84 -37.8 88.74 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.661 -0.699 . . . . 74.22 112.164 178.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 95.3 mt -73.49 -34.92 65.54 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.811 0.671 . . . . 75.1 112.811 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 10.0 p -81.29 -19.7 11.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.682 -0.636 . . . . 72.11 110.657 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 16.9 m -97.75 9.34 42.85 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 120.923 0.392 . . . . 70.01 111.144 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.498 ' O ' HG13 ' A' ' 186' ' ' ILE . 26.4 t-80 -81.63 106.29 13.46 Favored 'General case' 0 N--CA 1.432 -1.341 0 N-CA-C 107.636 -1.246 . . . . 75.11 107.636 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -66.45 -38.41 87.29 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.0 -0.545 . . . . 62.15 112.374 -172.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -69.33 -35.76 76.25 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.461 0.648 . . . . 75.12 109.814 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.7 tpt -64.81 -41.59 95.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.847 -1.07 . . . . 72.04 109.217 177.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 182' ' ' HIS . 79.5 mt -61.81 -42.41 94.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-N 115.903 -0.59 . . . . 74.21 110.341 177.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -60.21 -47.91 83.97 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 120.919 -0.312 . . . . 73.35 110.72 177.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.85 -36.03 76.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 116.121 -0.49 . . . . 65.45 110.727 -177.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -62.72 -49.79 73.65 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.591 -0.522 . . . . 64.21 109.591 177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.48 -35.31 77.35 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.97 0.414 . . . . 74.11 111.206 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.63 -40.72 84.61 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.612 -0.722 . . . . 63.44 109.798 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -70.79 -32.71 69.9 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.536 -0.466 . . . . 72.41 111.479 177.65 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -58.06 -41.49 83.43 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 120.825 0.345 . . . . 71.31 110.185 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -68.3 -41.95 80.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.115 -0.493 . . . . 72.22 110.176 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -68.78 -39.95 79.9 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 115.824 -0.625 . . . . 74.44 111.066 -176.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.45 -27.49 26.21 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 C-N-CA 120.549 -0.46 . . . . 74.2 109.945 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 201' ' ' LYS . 6.8 t70 -61.68 -48.61 80.01 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 116.015 -0.539 . . . . 60.34 109.936 175.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -64.67 -44.66 89.63 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.284 -0.566 . . . . 73.31 110.029 177.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 10.4 m0 -64.21 -40.38 95.95 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 112.758 0.651 . . . . 74.43 112.758 -177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 15.4 t -71.64 -34.07 69.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.275 -0.97 . . . . 73.03 110.144 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 197' ' ' ASP . 3.6 mmmp? -71.27 -45.36 63.35 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.713 -0.795 . . . . 70.55 109.399 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -58.04 -44.38 87.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.818 -0.628 . . . . 73.24 110.508 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -64.78 -40.52 95.38 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.826 -0.625 . . . . 71.4 110.195 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 42.0 m -69.44 -40.2 77.36 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.832 -0.622 . . . . 25.25 110.868 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -38.52 81.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 120.922 0.392 . . . . 71.11 110.335 178.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -63.56 -45.13 91.9 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.933 -0.576 . . . . 74.32 110.145 177.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.3 tp -64.3 -41.61 96.77 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.14 -0.482 . . . . 64.13 110.483 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.59 95.23 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.063 -0.517 . . . . 71.41 111.17 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -73.21 -33.02 65.13 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.419 -0.513 . . . . 73.23 110.792 -177.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.9 ttt -70.06 -40.97 74.75 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.883 -0.599 . . . . 73.52 110.034 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -71.93 -18.61 62.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.758 -0.655 . . . . 64.32 111.254 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.449 ' HA ' ' OE1' ' A' ' 212' ' ' GLU . 4.4 tp10 -84.02 -33.47 24.51 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.294 -0.562 . . . . 73.25 109.818 175.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 14.9 mm-40 -66.86 -50.37 62.73 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 109.478 -0.564 . . . . 73.5 109.478 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -161.57 -107.14 0.21 Allowed Glycine 0 N--CA 1.425 -2.078 0 N-CA-C 109.406 -1.478 . . . . 64.4 109.406 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 48.0 pt -130.96 171.96 17.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 C-N-CA 120.032 -0.667 . . . . 64.41 110.693 177.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.3 t -127.7 94.26 3.91 Favored 'General case' 0 N--CA 1.411 -2.419 0 N-CA-C 105.568 -2.012 . . . . 52.44 105.568 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -58.96 132.62 52.64 Favored Glycine 0 C--O 1.253 1.31 0 CA-C-N 115.157 -0.929 . . . . 64.15 112.322 -177.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -158.71 178.67 9.86 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.487 -1.301 . . . . 61.43 107.487 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -156.47 94.99 1.53 Allowed 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 109.413 -0.588 . . . . 72.12 109.413 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . 0.461 ' HA3' ' H ' ' A' ' 19' ' ' GLY . . . -80.94 53.38 4.6 Favored Glycine 0 C--N 1.303 -1.253 0 CA-C-N 115.664 -0.698 . . . . 50.23 113.102 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -135.63 81.97 1.92 Allowed 'General case' 0 C--N 1.288 -2.096 0 N-CA-C 104.016 -2.587 . . . . 75.15 104.016 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -47.21 -63.38 1.06 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 113.11 -1.859 . . . . 61.41 112.542 -173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 . . . . . 0 C--N 1.288 -2.093 0 N-CA-C 108.613 -0.884 . . . . 71.15 108.613 -177.66 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.801 0.334 . . . . 75.32 110.104 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.1 m -157.41 147.54 20.75 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.537 -0.912 . . . . 51.13 108.537 176.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.55 160.22 21.57 Favored Glycine 0 CA--C 1.49 -1.478 0 N-CA-C 110.259 -1.136 . . . . 74.44 110.259 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.1 tt -147.04 93.43 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 CA-C-O 122.376 1.084 . . . . 70.22 112.333 -176.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -124.43 122.38 37.48 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.095 -2.187 . . . . 72.41 105.095 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.87 113.89 1.37 Allowed Glycine 0 N--CA 1.421 -2.32 0 C-N-CA 120.292 -0.956 . . . . 51.34 112.075 -177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -147.42 65.67 1.13 Allowed 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 106.368 -1.716 . . . . 60.13 106.368 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 t -134.35 -169.13 2.27 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 114.443 -1.253 . . . . 54.13 108.429 -174.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -148.43 152.61 37.26 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 109.662 -0.495 . . . . 73.2 109.662 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -139.18 123.57 18.22 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 108.255 -1.017 . . . . 75.23 108.255 175.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -77.16 -48.78 16.75 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 105.118 -2.179 . . . . 73.54 105.118 175.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' A' ' 12' ' ' LYS 0.346 41.0 mmtt 61.47 67.81 0.76 Allowed 'General case' 0 N--CA 1.418 -2.042 0 CA-C-N 112.609 -2.087 . . . . 74.52 114.439 -176.295 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.8 ttp180 -118.12 82.61 1.87 Allowed 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 106.756 -1.572 . . . . 73.11 106.756 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -83.61 -47.78 10.91 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 107.189 -1.412 . . . . 71.22 107.189 175.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m 30.29 66.52 0.13 Allowed 'General case' 0 C--N 1.347 0.482 0 O-C-N 125.656 1.848 . . . . 75.22 114.175 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 58.2 t -81.15 95.08 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.773 0 N-CA-C 107.757 -1.201 . . . . 72.2 107.757 178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.7 p -79.4 81.99 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.423 -1.796 0 CA-C-O 122.823 1.297 . . . . 61.12 110.514 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -123.33 97.2 5.3 Favored 'General case' 0 N--CA 1.414 -2.259 0 N-CA-C 106.044 -1.836 . . . . 61.02 106.044 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.98 40.54 0.8 Allowed Glycine 0 CA--C 1.475 -2.429 0 N-CA-C 108.945 -1.662 . . . . 74.24 108.945 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.63 139.82 50.89 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.704 -0.748 . . . . 62.22 109.395 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.1 p -108.94 165.67 11.4 Favored 'General case' 0 C--N 1.278 -2.52 0 CA-C-N 115.606 -0.725 . . . . 72.21 109.834 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 29.5 m -71.96 101.69 2.75 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.992 -0.744 . . . . 64.21 108.992 176.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.62 119.6 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.287 0 N-CA-C 109.63 -0.508 . . . . 55.22 109.63 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 77.61 152.39 0.13 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.183 1.393 . . . . 75.14 109.876 -175.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.52 176.22 5.23 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.361 -0.607 . . . . 74.54 109.361 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.502 ' HB3' ' HA3' ' A' ' 158' ' ' GLY . 44.9 m -78.03 175.18 10.33 Favored 'General case' 0 N--CA 1.422 -1.846 0 N-CA-C 109.577 -0.527 . . . . 54.44 109.577 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.656 ' O ' HG12 ' A' ' 31' ' ' ILE . 2.9 mm? -73.58 -20.97 60.48 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 112.411 0.523 . . . . 74.53 112.411 -174.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -71.43 -44.68 64.4 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.648 -1.241 . . . . 62.53 107.648 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' OE1' ' HB2' ' A' ' 26' ' ' SER . 10.6 mp0 -66.31 -30.57 71.01 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.574 -1.194 . . . . 75.35 110.405 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -68.1 -45.03 74.83 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.338 -0.616 . . . . 60.12 109.338 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 27' ' ' LEU . 49.7 mm -62.1 -42.67 95.91 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 108.497 -0.927 . . . . 74.51 108.497 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.467 ' HA ' ' HE3' ' A' ' 82' ' ' LYS . 30.9 t70 -65.53 -38.96 91.17 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.679 -1.146 . . . . 74.52 110.608 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 71.8 t90 -67.1 -38.12 85.1 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 123.256 0.622 . . . . 70.14 110.148 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 78' ' ' PHE . 2.0 tm? -68.78 -39.39 80.19 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.673 -0.862 . . . . 74.44 108.673 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.42 94.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.744 -0.465 . . . . 72.22 109.744 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 39' ' ' SER . 40.7 mm-40 -70.39 -20.5 62.94 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.643 0.777 . . . . 73.33 112.304 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -68.16 -38.44 82.1 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 108.54 -0.911 . . . . 75.41 108.54 175.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -78.75 -35.68 44.27 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 72.31 110.352 174.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.486 ' HB2' ' HA ' ' A' ' 36' ' ' GLU . 14.2 m -92.83 32.01 1.32 Allowed 'General case' 0 N--CA 1.411 -2.391 0 CA-C-O 121.756 0.789 . . . . 65.34 109.732 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -85.28 124.02 31.43 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 121.6 0.714 . . . . 74.33 110.226 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 27.4 t70 -84.17 102.12 12.36 Favored 'General case' 0 C--N 1.277 -2.576 0 CA-C-N 115.317 -0.856 . . . . 72.42 111.041 176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -123.91 20.73 9.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.895 -1.15 . . . . 52.21 107.895 174.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.4 m -58.65 -25.72 63.05 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 113.536 -1.665 . . . . 74.42 111.571 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -67.88 -19.38 65.01 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.643 0.735 . . . . 74.4 110.727 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -102.0 127.14 49.0 Favored 'General case' 0 C--N 1.29 -1.998 0 CA-C-N 115.813 -0.63 . . . . 72.23 111.223 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -86.2 101.52 13.09 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.291 -1.003 . . . . 74.54 108.291 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.452 HG21 ' HG3' ' A' ' 99' ' ' ARG . 27.0 p -76.91 116.28 17.43 Favored 'General case' 0 CA--C 1.469 -2.144 0 CA-C-O 121.863 0.84 . . . . 73.31 111.824 -174.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -70.2 -168.42 0.22 Allowed 'General case' 1 N--CA 1.374 -4.237 0 CA-C-N 113.403 -1.726 . . . . 72.34 106.929 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -74.42 75.5 1.91 Allowed 'General case' 0 C--N 1.252 -3.671 0 CA-C-O 122.765 1.269 . . . . 72.41 111.325 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.748 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 28.5 m0 -56.95 112.65 1.39 Allowed 'General case' 0 C--N 1.295 -1.798 0 CA-C-N 112.828 -1.987 . . . . 63.3 106.211 165.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.66 ' HB2' ' HB3' ' A' ' 54' ' ' GLU . 23.9 p-10 -93.07 61.47 3.43 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-O 122.574 1.178 . . . . 74.34 108.291 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.486 ' O ' HG22 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -71.66 -46.51 58.68 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 105.987 -1.857 . . . . 73.11 105.987 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -66.22 -25.92 67.14 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.31 -1.768 . . . . 62.55 111.995 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.66 ' HB3' ' HB2' ' A' ' 51' ' ' ASN . 7.3 tm-20 -84.27 -43.13 15.15 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.78 -0.822 . . . . 61.24 108.78 178.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -69.73 -37.33 76.45 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.945 -0.57 . . . . 72.02 110.885 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 52' ' ' THR . 35.9 m -74.8 -19.78 16.62 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.123 0 C-N-CA 120.565 -0.454 . . . . 73.04 111.229 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 11.4 tmtt? -71.1 -25.75 62.74 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-O 121.583 0.706 . . . . 75.34 109.716 174.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -87.85 -41.75 13.01 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-O 121.784 0.802 . . . . 72.13 110.491 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 50.5 tp -78.44 -30.71 47.71 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.036 -0.984 . . . . 75.23 113.317 -174.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.541 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.1 tt -128.72 6.77 5.62 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-O 121.74 0.781 . . . . 74.33 109.135 -176.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.408 ' HA ' ' O ' ' A' ' 57' ' ' LYS . 44.2 m-80 71.4 -178.66 0.22 Allowed 'General case' 0 C--O 1.245 0.819 0 CA-C-N 115.386 -0.825 . . . . 74.01 110.829 -174.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.38 -6.29 3.16 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.971 1.471 . . . . 60.13 114.971 -173.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -64.72 -34.93 79.46 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.039 0.447 . . . . 65.2 110.922 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.03 11.48 29.64 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.718 1.007 . . . . 73.14 113.718 -172.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.6 t -58.1 125.89 14.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 121.101 0.476 . . . . 74.01 111.237 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.61 44.16 11.09 Favored Glycine 0 CA--C 1.5 -0.867 0 CA-C-N 114.588 -1.187 . . . . 54.13 110.683 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.2 tt -58.79 -46.22 90.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 113.151 0.797 . . . . 61.2 113.151 -172.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.35 -37.87 80.9 Favored 'General case' 0 C--O 1.206 -1.217 0 C-N-CA 119.589 -0.845 . . . . 75.41 111.016 -177.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.0 t -71.62 -37.6 70.89 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.3 0.571 . . . . 63.11 110.621 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.472 ' O ' HG12 ' A' ' 74' ' ' ILE . 1.5 tpm_? -70.65 -43.89 68.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.705 -0.68 . . . . 75.52 109.863 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 108' ' ' MET . 10.0 mp -72.01 -32.64 67.36 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 116.032 -0.531 . . . . 75.5 111.542 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.1 mp -65.44 -39.06 91.61 Favored 'General case' 0 C--N 1.312 -1.032 0 O-C-N 122.997 0.186 . . . . 55.15 111.494 176.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.47 -43.75 80.25 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 119.989 -0.684 . . . . 73.53 111.005 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 70' ' ' ARG . 14.5 pt -72.5 -36.53 54.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 C-N-CA 119.157 -1.017 . . . . 51.35 112.254 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.94 -34.58 71.62 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.198 -0.456 . . . . 73.22 111.81 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 76' ' ' LYS . 2.1 tmmm? -59.52 -46.16 89.66 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.014 -1.106 . . . . 75.03 108.014 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.87 -41.3 95.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.397 -0.819 . . . . 73.24 109.056 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.408 ' CD2' HD12 ' A' ' 34' ' ' LEU . 77.1 t80 -68.1 -39.2 82.88 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.361 -0.836 . . . . 62.23 110.63 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -63.74 -36.98 85.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.003 0.43 . . . . 64.03 110.307 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -58.67 -48.03 82.47 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.213 -1.032 . . . . 70.41 108.213 176.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.407 ' HG ' HD11 ' A' ' 179' ' ' LEU . 4.5 mm? -64.91 -37.72 88.58 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.323 -0.853 . . . . 74.04 112.481 175.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 32' ' ' ASP . 14.1 tmtt? -62.89 -36.14 82.35 Favored 'General case' 0 C--N 1.313 -1.014 0 C-N-CA 123.522 0.729 . . . . 75.34 109.254 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 6.6 t -69.82 -23.01 63.25 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 115.628 -0.715 . . . . 43.32 111.976 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.21 -39.93 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 109.791 -0.448 . . . . 72.11 109.791 177.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.7 tt -82.59 -30.91 29.25 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.037 0.384 . . . . 74.1 112.037 -176.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 73.7 m -100.61 128.73 46.56 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 109.374 -0.602 . . . . 43.42 109.374 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.41 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 6.5 t -79.74 142.35 35.51 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 120.399 -0.52 . . . . 74.41 110.537 -176.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 81.3 13.15 81.17 Favored Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.458 -0.792 . . . . 62.33 111.77 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.46 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 61.4 t -108.13 138.3 35.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 109.584 -0.525 . . . . 72.43 109.584 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -93.9 147.96 22.59 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 123.665 0.786 . . . . 55.31 111.305 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' H ' ' HG2' ' A' ' 91' ' ' GLU . 9.4 pt-20 -87.83 14.91 7.79 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.159 0.981 . . . . 71.21 111.968 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 58.3 m -144.43 112.4 5.08 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 107.567 -1.272 . . . . 55.21 107.567 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -88.31 160.93 6.9 Favored 'Trans proline' 0 N--CA 1.442 -1.533 0 C-N-CA 122.494 2.129 . . . . 72.11 111.819 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.06 -34.19 11.25 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.228 -1.027 . . . . 61.33 108.228 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 49.2 m80 -89.96 101.82 14.53 Favored 'General case' 0 N--CA 1.418 -2.047 0 N-CA-C 105.209 -2.145 . . . . 74.11 105.209 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.44 128.95 73.63 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.148 0 C-N-CA 119.689 -0.804 . . . . 71.32 111.409 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.72 134.21 47.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.274 -0.875 . . . . 73.2 111.161 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -102.4 -25.36 13.66 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-O 121.705 0.764 . . . . 55.1 110.022 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.748 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.5 mmt180 -141.97 150.1 40.95 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 124.136 0.974 . . . . 74.4 109.72 -175.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.4 t -117.07 112.5 39.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 106.595 -1.632 . . . . 74.22 106.595 176.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.4 m -59.91 143.68 87.26 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 109.246 -0.65 . . . . 73.52 109.246 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 83.2 Cg_exo -49.99 -40.23 49.75 Favored 'Trans proline' 0 N--CA 1.48 0.719 0 C-N-CA 123.127 2.551 . . . . 74.52 112.935 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.34 -38.75 81.32 Favored Glycine 0 C--N 1.309 -0.966 0 CA-C-N 115.548 -0.751 . . . . 63.22 111.699 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -70.48 -35.88 73.53 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.239 -0.652 . . . . 75.55 109.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.17 -45.04 96.27 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 115.079 -0.964 . . . . 54.22 110.892 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 69.0 mt -59.35 -41.26 83.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.983 0.42 . . . . 71.3 110.358 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.1 m -68.41 -41.94 79.71 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.929 -0.578 . . . . 75.21 110.275 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.417 ' SD ' HD23 ' A' ' 71' ' ' LEU . 27.3 ttt -63.67 -39.44 94.34 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 122.269 0.228 . . . . 72.24 110.923 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.514 ' HA ' ' SD ' ' A' ' 192' ' ' MET . 9.8 mp -61.61 -42.66 99.19 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.175 0.512 . . . . 71.11 111.206 177.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.1 m-85 -65.92 -45.88 80.29 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.99 -0.55 . . . . 71.5 111.076 176.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 98.6 t -65.37 -39.85 86.57 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.413 0 CA-C-N 116.082 -0.508 . . . . 63.31 111.472 -177.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.8 tp -66.42 -32.08 73.23 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.259 0.552 . . . . 72.32 109.997 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.6 m -74.73 -31.68 61.9 Favored 'General case' 0 N--CA 1.437 -1.075 0 CA-C-N 115.816 -0.629 . . . . 62.32 110.357 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 110' ' ' TYR . 79.6 mt -71.47 -49.98 43.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.711 -0.677 . . . . 73.31 109.312 175.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.488 ' HA ' ' OE2' ' A' ' 118' ' ' GLU . 89.9 m -60.67 -38.05 83.62 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.678 0.611 . . . . 61.22 112.516 -174.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 119' ' ' LEU . 52.7 t-80 -71.55 -27.33 63.1 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.013 -1.075 . . . . 71.34 109.634 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -73.29 -39.6 65.22 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.641 -0.708 . . . . 74.21 110.327 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' OE2' ' HA ' ' A' ' 115' ' ' THR 0.423 1.7 pm0 -76.18 -32.42 59.01 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 116.345 -2.142 . . . . 64.22 113.695 173.608 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.506 ' HG ' ' HA ' ' A' ' 116' ' ' HIS . 3.6 pp -67.1 -32.45 73.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 119.075 -1.05 . . . . 75.52 110.951 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.2 p -72.07 -37.73 69.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 120.455 -0.498 . . . . 45.02 110.217 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 14.7 m -71.0 -34.17 71.1 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.48 0.657 . . . . 63.4 109.613 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.4 tt -60.14 -50.6 73.03 Favored 'General case' 0 C--O 1.208 -1.104 0 C-N-CA 124.207 1.003 . . . . 64.42 109.033 175.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -64.9 -40.06 94.49 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.283 -0.417 . . . . 63.4 110.096 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -63.75 -41.33 98.03 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.051 -0.522 . . . . 72.54 111.632 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 27.9 mtpp -84.0 -29.06 27.27 Favored 'General case' 0 N--CA 1.427 -1.618 0 C-N-CA 118.77 -1.172 . . . . 44.54 112.256 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.638 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 22.3 mt -68.47 -40.75 82.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 C-N-CA 120.573 -0.451 . . . . 74.42 110.344 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 23.1 t70 -68.19 -29.76 68.69 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.205 -0.665 . . . . 71.34 109.205 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 36.3 tt0 -60.58 -55.41 33.72 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.683 0.793 . . . . 54.05 110.452 176.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.638 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.355 1.1 p90 -76.1 -18.79 59.02 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 113.958 1.096 . . . . 73.33 113.958 178.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -64.03 -34.18 77.43 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.931 -0.766 . . . . 72.2 108.931 172.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 127' ' ' ASP . 31.3 mmtp -81.03 -16.66 52.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.911 -0.586 . . . . 74.25 109.977 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 75.6 t -73.49 123.41 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 108.886 -0.783 . . . . 54.14 108.886 176.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -112.76 -179.84 3.77 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 114.964 -1.016 . . . . 50.53 111.732 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -72.0 100.61 2.52 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.592 -0.731 . . . . 74.25 110.95 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 40.6 t -95.19 152.1 18.65 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 115.552 -0.749 . . . . 34.34 109.064 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.27 -27.63 67.41 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 125.019 1.328 . . . . 74.21 110.347 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.81 11.81 0.79 Allowed 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 114.295 -1.321 . . . . 71.23 112.94 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.69 26.9 33.75 Favored Glycine 0 CA--C 1.495 -1.2 0 C-N-CA 121.184 -0.532 . . . . 35.13 112.227 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.2 m -94.42 122.57 37.13 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 107.53 -1.285 . . . . 72.12 107.53 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -87.55 171.9 10.16 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.093 0.473 . . . . 44.54 111.337 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 14.3 m -93.34 133.11 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.732 0 N-CA-C 107.369 -1.345 . . . . 74.2 107.369 176.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 129' ' ' TRP . 35.0 mm -92.3 99.22 9.35 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.411 0 CA-C-O 122.473 1.13 . . . . 42.22 108.888 -176.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -99.26 -38.88 8.7 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.496 -1.684 . . . . 73.4 111.434 -170.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -120.25 156.71 30.63 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.575 -0.739 . . . . 64.23 109.368 -170.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.518 HG22 ' H ' ' A' ' 167' ' ' VAL . 14.2 tt -69.74 -13.32 17.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.196 0 CA-C-O 121.71 0.767 . . . . 72.4 109.976 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -103.41 31.39 4.37 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.304 1.049 . . . . 75.42 109.918 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -95.86 156.96 16.11 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.735 -0.666 . . . . 74.01 109.443 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -48.18 -43.96 32.15 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.383 0.673 . . . . 72.54 112.476 -175.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -71.68 -36.39 70.59 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 116.203 -0.453 . . . . 71.14 111.53 -176.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -75.21 -44.27 47.28 Favored 'General case' 0 N--CA 1.417 -2.099 0 C-N-CA 120.669 -0.412 . . . . 71.31 110.039 178.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.505 ' O ' HG22 ' A' ' 155' ' ' VAL . 93.6 m-20 -58.2 -40.08 80.64 Favored 'General case' 0 C--O 1.208 -1.111 0 CA-C-N 115.767 -0.651 . . . . 64.05 111.041 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 28.7 m -64.44 -29.71 70.76 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-O 121.283 0.563 . . . . 72.22 111.787 -178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -83.66 -41.51 17.69 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.64 -0.504 . . . . 73.03 109.64 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' A' ' 150' ' ' THR . 45.9 m-85 -66.09 -43.74 86.42 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.674 -0.694 . . . . 65.53 112.331 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.9 m -63.85 -36.98 78.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 N-CA-C 112.019 0.378 . . . . 54.33 112.019 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.36 -33.91 76.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.977 -0.556 . . . . 73.34 110.864 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -81.01 -11.36 59.57 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 114.258 1.207 . . . . 74.53 114.258 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . 0.502 ' HA3' ' HB3' ' A' ' 26' ' ' SER . . . 117.03 -7.01 17.12 Favored Glycine 0 CA--C 1.491 -1.407 0 C-N-CA 118.876 -1.631 . . . . 63.2 113.409 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.478 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 49.9 m-85 -78.17 113.22 15.92 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 109.026 -0.731 . . . . 71.12 109.026 -178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.55 141.12 39.74 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.043 -1.095 . . . . 72.14 108.043 174.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.54 -24.96 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 121.368 0.604 . . . . 75.55 111.622 -175.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.56 -8.41 59.61 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 120.979 0.418 . . . . 74.24 111.032 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -102.54 -38.14 7.67 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.324 -0.398 . . . . 65.14 111.488 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.43 132.54 44.04 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.567 0.698 . . . . 33.51 109.675 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.41 ' HB2' ' N ' ' A' ' 87' ' ' THR . 66.3 t30 -88.5 118.67 28.31 Favored 'General case' 0 C--N 1.281 -2.374 0 N-CA-C 108.058 -1.09 . . . . 62.44 108.058 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -71.78 139.54 49.06 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.265 0.555 . . . . 74.54 110.033 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.518 ' H ' HG22 ' A' ' 145' ' ' ILE . 14.4 p -164.81 159.57 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.057 0 N-CA-C 106.802 -1.555 . . . . 74.31 106.802 -175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 4.1 p -68.64 143.61 54.75 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-O 121.296 0.569 . . . . 74.11 111.015 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.422 ' CD1' HG22 ' A' ' 142' ' ' ILE . 68.6 mt -77.91 -18.91 55.59 Favored 'General case' 0 CA--C 1.478 -1.812 0 CA-C-N 115.878 -0.601 . . . . 74.11 111.348 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -70.4 -37.0 74.41 Favored 'General case' 0 N--CA 1.42 -1.931 0 N-CA-C 108.21 -1.033 . . . . 61.11 108.21 176.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -75.19 -42.86 54.79 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.471 -0.786 . . . . 72.52 109.754 175.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.95 -43.87 91.28 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.612 -0.722 . . . . 71.45 109.829 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -71.9 -28.79 63.73 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 120.49 -0.484 . . . . 53.15 111.369 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 6.5 t -78.07 -32.22 50.62 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 119.732 -0.787 . . . . 72.44 110.791 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 12.0 p -78.14 -36.77 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.916 0 C-N-CA 119.257 -0.977 . . . . 70.23 110.425 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 88.7 t -71.32 -27.67 29.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.541 0.686 . . . . 61.3 109.303 176.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -63.47 -41.55 98.59 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-N 115.586 -0.734 . . . . 64.35 109.091 175.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.93 -40.41 87.61 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.663 -0.699 . . . . 70.04 110.437 177.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 90.3 mt -60.03 -42.41 94.32 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 73.43 111.497 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.62 -16.04 11.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 CA-C-O 121.133 0.492 . . . . 54.15 111.475 -178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 19.0 m -98.49 3.22 48.22 Favored 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.298 0.571 . . . . 64.22 110.431 176.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 63.0 t-80 -78.69 109.58 13.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 107.959 -1.126 . . . . 73.34 107.959 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.87 -41.34 77.81 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 124.945 1.298 . . . . 64.22 111.599 -174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.587 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.7 t70 -70.82 -41.49 71.49 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.961 -1.018 . . . . 64.31 112.0 -175.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.4 tpt -67.01 -45.75 76.6 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.097 -0.501 . . . . 70.13 111.166 177.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 37.0 pt -70.66 -21.02 22.56 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 CA-C-O 121.025 0.441 . . . . 72.44 112.062 -177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -77.42 -49.27 15.2 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 110.118 -0.327 . . . . 75.21 110.118 174.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 86.7 mt -62.64 -42.46 96.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.877 -0.602 . . . . 71.13 110.231 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -65.43 -41.4 93.58 Favored 'General case' 0 C--O 1.204 -1.303 0 CA-C-N 116.347 -0.388 . . . . 74.22 111.713 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -69.07 -36.99 78.24 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.197 0.522 . . . . 72.13 111.212 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -71.88 -36.29 70.03 Favored 'General case' 0 C--O 1.245 0.836 0 CA-C-O 121.49 0.662 . . . . 72.41 109.949 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.514 ' SD ' ' HA ' ' A' ' 109' ' ' LEU . 47.8 ttm -72.99 -36.6 67.08 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.815 -1.084 . . . . 64.52 110.191 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -59.93 -45.48 92.46 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 123.293 0.637 . . . . 74.35 109.789 177.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -64.51 -39.91 94.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.115 0.483 . . . . 75.03 110.001 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -63.1 -46.22 88.36 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.498 -0.774 . . . . 74.53 111.431 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 192' ' ' MET . 21.4 m -72.42 -28.24 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-O 121.095 0.474 . . . . 65.01 110.572 -176.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -68.79 -41.15 79.11 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.506 -0.924 . . . . 74.54 108.506 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -68.73 -42.58 77.44 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.268 -0.878 . . . . 74.42 109.669 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -67.16 -36.2 81.31 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.908 0.707 . . . . 60.32 112.908 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 11.1 t -73.25 -33.05 65.06 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.899 -0.721 . . . . 62.44 110.075 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -45.54 70.13 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.933 -1.136 . . . . 72.45 107.933 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 206' ' ' ARG . 39.6 tt0 -61.81 -41.89 98.33 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.34 -0.846 . . . . 71.41 110.579 178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.58 -43.89 97.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.806 0.336 . . . . 70.23 110.15 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.7 m -66.53 -36.14 81.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.827 -0.624 . . . . 64.22 110.218 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -69.12 -43.46 74.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 115.454 -0.794 . . . . 44.31 110.231 178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 202' ' ' GLU . 78.8 mtp180 -66.19 -36.19 82.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.595 -0.52 . . . . 72.32 109.595 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -66.26 -46.11 78.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.378 -0.828 . . . . 73.24 109.401 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.25 -42.08 98.01 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 120.982 0.42 . . . . 65.13 111.911 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.74 -34.67 67.2 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.614 -0.434 . . . . 72.32 110.804 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 51.2 ttp -73.87 -31.02 62.95 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 116.378 -0.373 . . . . 63.51 110.262 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.31 -32.36 72.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.344 0.593 . . . . 74.03 110.676 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.32 -38.65 26.41 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 115.837 -0.62 . . . . 72.04 109.726 177.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -63.71 -41.95 98.01 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.694 -0.685 . . . . 51.21 111.383 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -168.78 -119.67 0.5 Allowed Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 120.979 -0.629 . . . . 73.14 111.972 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.68 142.39 21.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 N-CA-C 108.828 -0.804 . . . . 74.51 108.828 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.8 m -120.77 175.54 5.98 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 116.6 -0.273 . . . . 75.14 110.482 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 143.84 140.89 3.71 Favored Glycine 0 N--CA 1.427 -1.913 0 N-CA-C 108.689 -1.764 . . . . 71.12 108.689 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.61 -67.97 0.43 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 117.246 0.523 . . . . 63.12 109.604 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 55.9 tptt 170.09 116.25 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 124.937 1.295 . . . . 74.5 108.055 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -78.97 85.02 1.21 Allowed Glycine 0 N--CA 1.437 -1.248 0 N-CA-C 109.354 -1.499 . . . . 63.31 109.354 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp -78.78 -41.03 31.55 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 108.765 -0.828 . . . . 71.51 108.765 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -116.76 104.38 11.28 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 115.163 -0.926 . . . . 75.3 109.184 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--O 1.251 1.143 0 N-CA-C 107.659 -1.237 . . . . 73.5 107.659 179.442 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.947 -0.76 . . . . 73.22 108.947 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 p -142.13 147.28 36.41 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 110.001 -0.37 . . . . 53.53 110.001 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.47 175.46 21.2 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.314 -1.114 . . . . 63.42 110.314 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.3 tt -162.22 99.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.328 0 CA-C-O 121.956 0.884 . . . . 70.32 110.688 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.38 117.91 30.65 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.117 -0.947 . . . . 74.14 108.807 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -84.68 123.58 6.33 Favored Glycine 0 N--CA 1.432 -1.582 0 CA-C-N 116.044 -0.525 . . . . 32.4 112.487 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.1 m -133.0 86.79 2.34 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 109.337 -0.616 . . . . 72.2 109.337 177.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.3 t -153.42 115.37 4.31 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.904 -0.589 . . . . 73.35 109.951 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.8 143.7 48.71 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.86 -0.793 . . . . 75.42 108.86 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -119.79 149.69 41.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.971 -0.751 . . . . 72.35 108.971 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.54 -32.44 67.09 Favored 'General case' 0 C--N 1.323 -0.555 0 O-C-N 123.538 0.524 . . . . 75.43 112.139 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 49.62 67.54 0.88 Allowed 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.918 0.887 . . . . 72.43 111.614 -176.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.5 mtt180 -78.56 139.99 38.55 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.892 -1.049 . . . . 74.22 111.241 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -80.86 -15.19 57.0 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.898 -0.592 . . . . 72.41 110.561 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.5 m 75.8 82.43 0.1 Allowed 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.969 1.308 . . . . 72.34 111.959 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.9 p -82.02 89.6 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 CA-C-O 122.698 1.237 . . . . 51.54 108.74 176.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.87 160.34 35.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-N 114.357 -1.292 . . . . 71.03 108.742 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.38 126.94 48.22 Favored 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 107.951 -1.129 . . . . 74.13 107.951 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.28 116.81 5.26 Favored Glycine 0 C--N 1.303 -1.26 0 N-CA-C 110.718 -0.953 . . . . 75.41 110.718 -179.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -104.42 132.03 51.13 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.064 0.459 . . . . 62.42 111.477 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.1 t -145.02 160.77 40.84 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 106.744 -1.576 . . . . 74.43 106.744 175.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.7 m -83.12 98.32 9.27 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 120.664 0.269 . . . . 63.25 110.456 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -79.6 119.34 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.608 0 CA-C-O 121.158 0.504 . . . . 72.03 110.411 178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 66.9 96.6 0.06 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 114.731 -1.122 . . . . 62.42 111.875 -174.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.75 167.59 20.53 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 114.534 -1.212 . . . . 71.0 107.737 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.7 m -71.88 161.26 31.21 Favored 'General case' 0 N--CA 1.409 -2.48 0 N-CA-C 108.658 -0.867 . . . . 63.11 108.658 -176.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.434 ' O ' HD13 ' A' ' 31' ' ' ILE . 2.8 mm? -66.42 -23.27 66.28 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-O 121.06 0.457 . . . . 74.23 110.262 -175.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -74.14 -43.78 56.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 108.675 -0.861 . . . . 75.01 108.675 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -68.02 -33.37 74.47 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.063 -0.972 . . . . 61.25 110.414 -178.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -68.46 -43.54 76.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.834 -0.802 . . . . 65.23 108.834 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.434 HD13 ' O ' ' A' ' 27' ' ' LEU . 1.7 mp -71.11 -37.28 66.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 115.145 -0.934 . . . . 64.5 110.584 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -62.26 -37.49 85.67 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 116.38 -0.373 . . . . 73.15 110.212 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -67.72 -42.32 82.13 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.714 0.634 . . . . 54.1 109.529 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.604 ' HB2' HG11 ' A' ' 111' ' ' VAL . 53.8 tp -61.56 -45.13 95.45 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.183 0.516 . . . . 73.1 110.04 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.61 87.28 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.385 -0.825 . . . . 71.53 110.13 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -67.27 -42.65 83.49 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 115.418 -0.81 . . . . 72.24 109.243 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.8 tpt180 -69.14 -35.53 76.46 Favored 'General case' 0 N--CA 1.439 -1.012 0 O-C-N 123.287 0.367 . . . . 71.33 110.799 -177.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.422 ' CE1' HG13 ' A' ' 96' ' ' VAL . 58.3 t80 -73.76 -31.2 63.21 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 120.433 -0.507 . . . . 72.32 110.805 176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 20.2 m -91.45 17.01 9.12 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 124.106 0.962 . . . . 71.24 111.047 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -116.17 125.61 52.53 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 110.371 -0.233 . . . . 63.11 110.371 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -98.37 139.75 33.67 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.76 -0.83 . . . . 73.04 108.76 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.292 1.1 pp -95.15 67.37 3.03 Favored 'General case' 0 N--CA 1.406 -2.639 0 CA-C-O 123.136 1.446 . . . . 71.02 111.744 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.2 m -63.88 -27.87 69.45 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.397 -1.729 . . . . 75.55 111.02 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -91.56 6.17 46.72 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.879 -0.6 . . . . 73.22 111.193 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -110.87 143.32 41.67 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.259 -0.275 . . . . 73.3 110.259 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -105.67 122.77 46.73 Favored 'General case' 0 CA--C 1.486 -1.5 0 N-CA-C 107.395 -1.335 . . . . 62.2 107.395 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.723 HG21 ' HG3' ' A' ' 99' ' ' ARG . 28.8 p -108.56 94.05 4.85 Favored 'General case' 0 N--CA 1.409 -2.507 0 C-N-CA 118.838 -1.145 . . . . 64.11 111.448 -174.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 24.9 m -122.71 104.88 9.6 Favored 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 107.905 -1.146 . . . . 62.31 107.905 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 2.8 mmpt? 63.76 63.18 0.86 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 113.626 0.972 . . . . 73.53 113.626 -176.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.605 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 11.0 m0 -80.15 102.12 9.21 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 106.828 -1.545 . . . . 73.14 106.828 166.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.552 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 49.7 m-80 -91.88 62.87 4.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 122.025 0.917 . . . . 72.05 110.422 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -76.12 -46.69 27.6 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 114.843 -1.072 . . . . 61.53 108.179 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -67.55 -28.26 67.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.432 -1.258 . . . . 65.31 110.447 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 1.0 OUTLIER -73.06 -46.36 52.14 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.656 -1.156 . . . . 74.41 109.59 -178.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 21.4 mmmt -77.4 -30.59 53.65 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 119.031 -1.068 . . . . 74.05 110.688 -175.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -75.27 -18.66 16.03 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.352 0 C-N-CA 119.537 -0.865 . . . . 51.21 111.065 177.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HG3' ' HA ' ' A' ' 62' ' ' GLU . 35.5 ttmt -68.43 -28.39 67.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 119.958 -0.697 . . . . 63.5 109.412 174.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.39 -38.8 19.83 Favored 'General case' 0 C--N 1.308 -1.198 0 C-N-CA 120.368 -0.533 . . . . 71.22 110.888 174.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 87.0 mt -79.55 -30.43 41.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.942 1.089 . . . . 74.02 113.942 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HB3' ' CB ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER -134.91 14.34 3.61 Favored 'General case' 0 C--O 1.25 1.089 0 CA-C-O 121.199 0.524 . . . . 62.14 110.493 -173.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.1 m120 74.67 176.2 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.015 0.926 . . . . 73.4 113.242 177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.454 ' HA ' ' HG3' ' A' ' 57' ' ' LYS . 19.5 tp10 -55.64 -32.76 63.46 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.276 1.43 . . . . 61.14 110.623 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.65 ' HB2' ' OH ' ' A' ' 187' ' ' TYR . 22.7 pttp -73.3 6.68 2.69 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.637 -1.165 . . . . 64.24 113.565 -174.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.426 ' CB ' ' HB3' ' A' ' 60' ' ' LEU . . . -121.93 12.78 10.52 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.015 0.436 . . . . 64.03 111.358 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.12 131.19 30.92 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 CA-C-O 121.724 0.773 . . . . 74.42 111.705 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 92.34 31.38 9.02 Favored Glycine 0 C--N 1.309 -0.95 0 CA-C-N 115.143 -0.935 . . . . 21.32 111.809 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -56.35 -45.35 81.46 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.814 0 C-N-CA 123.536 0.734 . . . . 72.13 112.63 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 8.4 pt-20 -62.24 -41.94 98.88 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.585 0.231 . . . . 75.51 111.599 -177.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.6 m -74.99 -34.65 61.99 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.212 0.529 . . . . 73.33 109.97 -178.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 5.8 tpp180 -65.93 -46.62 77.57 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.307 -0.86 . . . . 75.02 109.488 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.25 -36.36 83.39 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.468 -0.787 . . . . 71.4 111.599 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.3 mt -63.29 -46.55 86.26 Favored 'General case' 0 C--N 1.315 -0.909 0 O-C-N 123.148 0.28 . . . . 75.15 110.702 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.2 -35.58 78.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.411 . . . . 74.35 111.817 -177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.8 mt -79.02 -33.6 16.09 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.917 -0.313 . . . . 64.45 110.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.46 92.0 Favored 'General case' 0 C--O 1.196 -1.731 0 N-CA-C 108.219 -1.03 . . . . 75.2 108.219 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.4 -41.36 69.2 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.961 0.904 . . . . 61.31 111.948 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.85 -43.9 91.52 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 109.379 -0.6 . . . . 72.04 109.379 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -74.92 -25.61 59.03 Favored 'General case' 0 CA--C 1.497 -1.06 0 CA-C-N 116.129 -0.487 . . . . 74.45 110.725 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.464 ' CE1' ' HG3' ' A' ' 93' ' ' PRO . 58.5 t-80 -66.12 -49.95 65.74 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 115.34 -0.845 . . . . 70.32 109.086 177.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -58.4 -46.36 86.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.816 -0.809 . . . . 73.45 108.816 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -73.65 -37.27 65.37 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.16 1.17 . . . . 73.12 114.16 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -84.64 -24.39 29.09 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.323 -0.861 . . . . 65.23 113.226 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.1 m -72.87 -32.63 65.54 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 118.116 0.416 . . . . 51.42 111.192 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 11.7 p -73.55 -20.34 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 122.105 0.955 . . . . 63.34 109.153 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.1 tp -90.17 -14.4 33.62 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 115.049 -0.978 . . . . 71.43 111.233 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 67.7 m -111.22 152.46 27.08 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.826 -0.546 . . . . 73.43 110.254 178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 27.8 m -92.01 133.1 36.03 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 109.459 -0.571 . . . . 72.25 109.459 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 84.43 14.48 70.98 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.706 -0.759 . . . . 52.13 113.481 175.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.7 t -119.81 115.07 46.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.341 -0.985 . . . . 73.34 108.341 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -79.04 137.8 37.72 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 116.376 -0.375 . . . . 51.15 111.422 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -73.76 -15.22 61.21 Favored 'General case' 0 C--N 1.318 -0.78 0 O-C-N 124.151 0.907 . . . . 71.02 110.393 -179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.3 m -117.14 99.21 52.72 Favored Pre-proline 0 C--N 1.285 -2.229 0 N-CA-C 108.19 -1.041 . . . . 73.41 108.19 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HG3' ' CE1' ' A' ' 79' ' ' HIS . 7.9 Cg_exo -70.91 157.43 58.18 Favored 'Trans proline' 0 C--O 1.244 0.779 0 C-N-CA 122.213 1.942 . . . . 74.32 111.167 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.91 -8.44 21.57 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.649 -0.871 . . . . 73.22 108.649 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.425 ' O ' ' HA ' ' A' ' 39' ' ' SER . 49.4 m80 -133.03 103.78 6.21 Favored 'General case' 0 N--CA 1.416 -2.153 0 N-CA-C 105.279 -2.119 . . . . 75.14 105.279 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.422 HG13 ' CE1' ' A' ' 38' ' ' TYR . 97.4 t -104.53 122.47 57.54 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.146 0 N-CA-C 109.013 -0.736 . . . . 64.4 109.013 176.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.6 137.6 57.39 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.731 0.644 . . . . 51.05 111.167 178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -106.41 -31.48 8.55 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 116.143 -0.48 . . . . 72.03 110.719 178.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.723 ' HG3' HG21 ' A' ' 47' ' ' THR . 39.9 mmt180 -123.98 128.28 49.16 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 122.172 -0.33 . . . . 75.24 111.436 -175.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 66.5 t -106.48 120.38 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 106.513 -1.662 . . . . 70.35 106.513 175.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 96.8 p -78.07 160.7 73.06 Favored Pre-proline 0 C--N 1.308 -1.211 0 N-CA-C 109.085 -0.709 . . . . 53.2 109.085 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' O ' HG13 ' A' ' 106' ' ' ILE . 9.6 Cg_endo -54.28 -37.35 88.36 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.324 2.016 . . . . 73.32 111.653 175.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.12 -43.68 89.41 Favored Glycine 0 C--O 1.24 0.528 0 CA-C-N 115.408 -0.815 . . . . 53.25 111.679 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -68.19 -39.65 82.41 Favored 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 110.264 -0.273 . . . . 70.11 110.264 178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -57.13 -43.38 82.33 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 123.661 0.784 . . . . 63.51 111.376 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 102' ' ' PRO . 74.7 mt -61.25 -45.04 99.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 O-C-N 123.301 0.376 . . . . 75.23 110.075 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 111' ' ' VAL . 51.1 m -70.75 -38.8 73.52 Favored 'General case' 0 N--CA 1.423 -1.818 0 CA-C-N 115.962 -0.563 . . . . 72.32 110.8 -178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.441 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 89.9 mtp -67.99 -36.27 79.72 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-O 119.555 -0.259 . . . . 65.15 111.623 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 90.2 mt -62.51 -41.13 98.63 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.178 0.513 . . . . 64.13 109.631 177.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.23 -45.66 87.2 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.274 -0.875 . . . . 74.31 110.685 176.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.604 HG11 ' HB2' ' A' ' 34' ' ' LEU . 65.2 t -63.2 -40.68 89.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 O-C-N 123.236 0.335 . . . . 53.43 111.123 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 108' ' ' MET . 86.5 mt -63.07 -39.51 94.95 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.079 0.466 . . . . 61.33 110.215 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.0 m -68.59 -42.18 78.6 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.647 -0.706 . . . . 64.14 109.872 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.5 mt -64.55 -43.29 96.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.994 -0.548 . . . . 73.42 111.477 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.462 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 10.4 t -74.74 -21.74 59.19 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.354 -0.539 . . . . 74.05 112.077 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 16.5 t-160 -83.56 -22.65 32.3 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.097 -1.041 . . . . 74.44 108.519 176.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -80.3 -41.36 25.04 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.836 -1.075 . . . . 73.44 110.411 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.462 ' HG3' ' HA ' ' A' ' 115' ' ' THR . 0.0 OUTLIER -73.24 -31.2 63.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 120.615 -0.434 . . . . 73.43 111.314 177.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.43 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 54.1 tp -63.87 -45.16 90.69 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 115.573 -0.74 . . . . 65.41 110.537 177.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 43.4 m -66.66 -33.23 75.2 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.906 -0.588 . . . . 74.25 110.144 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.2 t -70.94 -39.97 72.3 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.28 -0.873 . . . . 73.34 110.382 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.753 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.6 pp -68.92 -44.87 72.24 Favored 'General case' 0 C--O 1.192 -1.957 0 C-N-CA 120.099 -0.64 . . . . 74.12 110.394 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.404 ' N ' HD12 ' A' ' 122' ' ' LEU 0.29 0.0 OUTLIER -67.88 -31.73 71.74 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 118.874 -1.13 . . . . 43.41 112.936 -175.188 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.12 -32.17 56.26 Favored 'General case' 0 C--O 1.245 0.868 0 C-N-CA 120.037 -0.665 . . . . 71.04 111.714 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -86.41 -33.7 20.39 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 119.82 -0.752 . . . . 62.34 112.74 175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.503 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 56.3 mt -67.26 -40.9 85.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 116.603 -0.271 . . . . 73.53 110.628 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -61.02 -30.28 70.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.015 0.436 . . . . 62.34 110.43 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -67.48 -51.56 49.75 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.315 -0.857 . . . . 53.4 110.183 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.503 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.3 3.1 p90 -77.61 -19.64 55.22 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 119.765 -0.774 . . . . 74.43 112.948 179.084 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -68.04 -32.2 72.4 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.029 -1.1 . . . . 52.01 108.029 172.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -74.47 -25.89 59.68 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.166 -0.924 . . . . 74.2 110.221 177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -70.01 127.58 32.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.658 -0.867 . . . . 74.4 108.658 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.531 ' HA ' HG12 ' A' ' 141' ' ' VAL . 21.4 ptmt -113.61 -172.9 2.16 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.894 -0.594 . . . . 74.35 111.245 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -57.96 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.278 0.986 . . . . 72.24 109.591 175.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 26.5 m -99.05 168.69 9.92 Favored 'General case' 0 N--CA 1.418 -2.036 0 CA-C-N 114.873 -1.058 . . . . 72.15 110.868 -177.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -63.12 -21.42 66.18 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 124.508 1.123 . . . . 51.55 114.0 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -87.09 -0.89 57.38 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.87 -0.604 . . . . 63.22 112.038 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 93.98 18.95 35.32 Favored Glycine 0 CA--C 1.502 -0.755 0 C-N-CA 120.75 -0.738 . . . . 71.13 111.724 -179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 11.5 m -64.29 137.24 57.82 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 123.324 0.65 . . . . 72.25 110.053 178.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.444 ' HG3' ' OD2' ' A' ' 147' ' ' ASP . 35.0 mmtp -78.82 167.08 21.69 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 123.33 0.652 . . . . 62.22 111.344 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' A' ' 133' ' ' LYS . 29.4 m -93.57 130.19 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 N-CA-C 104.039 -2.578 . . . . 71.34 104.039 164.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.02 93.31 4.16 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 C-N-CA 118.684 -1.206 . . . . 74.55 110.156 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -101.94 -36.4 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.021 -0.99 . . . . 64.24 109.71 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -116.58 144.92 43.78 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.263 0.554 . . . . 70.23 109.943 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 11.0 tt -60.25 -33.48 53.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 114.653 -1.158 . . . . 64.51 113.066 -175.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -83.15 36.15 0.51 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 113.975 1.102 . . . . 74.45 113.975 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.444 ' OD2' ' HG3' ' A' ' 140' ' ' LYS . 15.1 t70 -103.33 153.81 20.04 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.621 -1.622 . . . . 65.22 106.621 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -52.64 -42.85 65.03 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 114.076 1.139 . . . . 75.44 114.076 -170.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -76.03 -28.53 57.75 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.864 -0.734 . . . . 63.23 112.417 -176.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.25 -40.94 62.04 Favored 'General case' 0 N--CA 1.421 -1.884 0 N-CA-C 107.512 -1.292 . . . . 63.54 107.512 176.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.507 ' O ' HG22 ' A' ' 155' ' ' VAL . 89.8 m-20 -60.43 -37.14 79.95 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 115.016 -0.993 . . . . 75.33 109.492 177.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 55.1 m -58.18 -34.09 69.95 Favored 'General case' 0 C--O 1.245 0.834 0 O-C-N 123.308 0.38 . . . . 72.51 111.781 -179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.753 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 87.0 t90 -82.39 -43.35 17.47 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.156 -0.683 . . . . 74.23 109.156 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.2 m-85 -62.38 -44.09 97.29 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.375 -0.83 . . . . 74.32 112.822 -176.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 151' ' ' ASN . 30.5 m -65.88 -32.99 60.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 111.741 0.274 . . . . 71.42 111.741 178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.94 -41.56 97.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.458 0.647 . . . . 43.1 109.91 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -76.93 -12.22 59.92 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 113.433 0.901 . . . . 72.41 113.433 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.81 -8.02 17.03 Favored Glycine 0 CA--C 1.49 -1.513 0 C-N-CA 119.975 -1.107 . . . . 41.04 112.975 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.474 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 52.1 m-85 -74.67 113.7 12.24 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 109.537 -0.542 . . . . 74.45 109.537 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.431 ' HD2' ' N ' ' A' ' 160' ' ' LYS . 12.6 mptt -73.55 145.22 45.69 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.783 -1.192 . . . . 64.14 107.783 173.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 16.2 t -68.22 -20.84 26.02 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-O 121.668 0.746 . . . . 62.34 110.115 -174.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.75 -19.41 30.83 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.977 -0.556 . . . . 62.33 111.376 176.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -87.67 -29.71 20.95 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 116.702 -0.226 . . . . 40.11 111.117 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.4 pp -79.99 142.51 34.96 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.48 0.657 . . . . 74.41 111.273 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -94.83 147.16 23.64 Favored 'General case' 0 C--N 1.295 -1.783 0 C-N-CA 123.756 0.823 . . . . 74.41 110.293 -173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.99 129.13 38.91 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.226 1.01 . . . . 74.45 110.113 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -170.5 157.34 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.251 1.154 0 N-CA-C 108.841 -0.799 . . . . 50.44 108.841 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 5.5 m -86.19 144.54 27.42 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 106.629 -1.619 . . . . 74.45 106.629 175.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.72 -31.15 63.24 Favored 'General case' 0 C--N 1.281 -2.413 0 CA-C-N 115.52 -0.763 . . . . 74.41 110.74 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.23 -36.3 77.07 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 120.211 -0.596 . . . . 71.24 109.816 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -74.99 -43.86 51.51 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 118.812 -1.155 . . . . 73.23 109.345 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 176' ' ' VAL . 47.9 tp -60.84 -48.74 80.43 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.569 -0.741 . . . . 72.12 110.963 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.11 -34.77 78.34 Favored 'General case' 0 CA--C 1.496 -1.134 0 O-C-N 123.276 0.36 . . . . 53.44 110.826 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 35.0 m -72.25 -40.16 67.89 Favored 'General case' 0 N--CA 1.424 -1.732 0 C-N-CA 119.851 -0.74 . . . . 73.54 111.415 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.8 p -75.81 -37.32 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 C-N-CA 118.732 -1.187 . . . . 62.01 110.631 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.42 HG12 ' O ' ' A' ' 172' ' ' LEU . 9.7 p -76.59 -34.85 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 119.633 -0.827 . . . . 50.25 110.742 -176.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -71.91 -32.46 67.4 Favored 'General case' 0 C--O 1.211 -0.963 0 C-N-CA 120.356 -0.538 . . . . 74.01 110.091 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.42 -44.9 77.65 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 109.949 -0.389 . . . . 75.35 109.949 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -67.57 -34.61 77.4 Favored 'General case' 0 C--O 1.201 -1.463 0 N-CA-C 112.768 0.655 . . . . 73.13 112.768 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 34.0 m -83.6 -14.86 11.58 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 C-N-CA 119.152 -1.019 . . . . 72.24 112.575 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 47.7 m -91.41 8.91 33.98 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 120.509 -0.476 . . . . 63.31 112.282 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 23.0 p80 -70.88 146.35 49.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 117.969 -1.493 . . . . 74.01 108.528 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -63.01 -23.73 67.59 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.02 1.119 . . . . 23.05 114.02 -170.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.493 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -75.96 -37.33 58.74 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.561 -0.533 . . . . 74.44 109.561 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 14.7 tpt -69.84 -40.84 75.58 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.698 -0.683 . . . . 61.0 110.363 178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.29 -39.7 79.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.072 -0.714 . . . . 75.34 109.072 176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 63' ' ' LYS . 37.3 t80 -65.37 -42.89 92.24 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.344 -0.844 . . . . 74.12 111.18 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.565 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.5 mp -64.36 -42.14 94.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 116.471 -0.331 . . . . 74.1 111.064 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -64.17 -37.49 87.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.746 0.308 . . . . 74.24 110.176 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.83 -45.89 84.25 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.841 -0.618 . . . . 72.33 110.399 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -68.0 -37.87 81.97 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.536 -0.756 . . . . 32.44 110.566 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.565 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -66.99 -42.74 84.51 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-N 115.944 -0.571 . . . . 75.44 110.267 177.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -60.46 -44.8 95.49 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.49 -0.93 . . . . 75.22 108.49 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.44 -42.87 99.43 Favored 'General case' 0 C--O 1.251 1.179 0 CA-C-N 116.017 -0.538 . . . . 64.23 111.603 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -70.56 -39.55 73.87 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.516 -0.766 . . . . 74.52 110.511 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.0 m -72.27 -26.17 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 120.228 -0.589 . . . . 74.12 110.388 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -61.57 -53.8 51.53 Favored 'General case' 0 CA--C 1.487 -1.477 0 N-CA-C 107.924 -1.139 . . . . 65.43 107.924 172.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -55.54 -48.14 75.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 114.898 -1.046 . . . . 51.15 110.69 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 46.6 m0 -70.55 -33.3 70.98 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 112.832 0.679 . . . . 74.43 112.832 -176.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 203' ' ' GLU . 30.9 m -73.97 -35.4 64.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 119.557 -0.857 . . . . 74.31 109.892 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -72.96 -36.5 67.15 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.318 0.58 . . . . 71.44 110.309 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -70.36 -45.23 66.51 Favored 'General case' 0 N--CA 1.427 -1.604 0 CA-C-N 115.717 -0.674 . . . . 71.35 109.578 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 200' ' ' THR . 13.0 pt-20 -69.41 -35.5 75.8 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.16 -0.616 . . . . 74.13 110.803 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 45.2 t -62.47 -41.83 99.05 Favored 'General case' 0 C--O 1.247 0.936 0 N-CA-C 109.896 -0.409 . . . . 63.31 109.896 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -76.95 -30.15 55.91 Favored 'General case' 0 N--CA 1.422 -1.841 0 C-N-CA 120.313 -0.555 . . . . 62.04 109.738 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -64.11 -46.83 82.44 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.57 -0.53 . . . . 44.44 109.57 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.23 -40.61 96.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.479 -0.328 . . . . 74.32 110.679 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -67.51 -40.09 85.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.007 0.432 . . . . 74.22 111.279 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 49.2 ttm -69.98 -40.61 75.25 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.92 -0.582 . . . . 74.14 110.057 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 56.4 ttp -67.71 -40.98 84.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.828 -0.624 . . . . 64.24 109.776 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.78 -27.24 66.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.058 -0.519 . . . . 72.04 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -79.03 -49.06 13.3 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.896 -0.593 . . . . 70.14 109.713 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -58.16 5.59 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.255 -0.884 . . . . 61.31 112.105 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -149.08 111.04 0.51 Allowed Glycine 0 N--CA 1.425 -2.036 0 C-N-CA 120.066 -1.064 . . . . 63.1 111.539 -176.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 2.7 mp -64.39 117.03 4.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.981 -0.748 . . . . 72.33 108.981 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.1 t -84.66 150.96 24.79 Favored 'General case' 0 N--CA 1.428 -1.572 0 N-CA-C 109.256 -0.646 . . . . 63.33 109.256 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -81.51 134.15 12.85 Favored Glycine 0 N--CA 1.433 -1.507 0 N-CA-C 110.916 -0.874 . . . . 43.32 110.916 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -80.19 117.15 20.73 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.27 -0.641 . . . . 54.52 109.27 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -127.2 133.11 50.32 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.14 -0.689 . . . . 74.33 109.14 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 174.05 177.83 43.53 Favored Glycine 0 N--CA 1.417 -2.575 0 N-CA-C 110.513 -1.035 . . . . 71.13 110.513 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.61 148.49 25.94 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 110.11 -0.33 . . . . 62.55 110.11 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 63.1 tttp 177.19 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 107.725 -1.213 . . . . 72.14 107.725 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.7 t70 . . . . . 0 C--N 1.318 -0.779 0 N-CA-C 107.398 -1.334 . . . . 73.32 107.398 179.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.429 -1.514 0 N-CA-C 109.138 -0.69 . . . . 64.05 109.138 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 p -134.72 148.15 50.22 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.451 -0.574 . . . . 72.0 109.451 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 147.3 174.52 19.38 Favored Glycine 0 N--CA 1.436 -1.302 0 N-CA-C 111.601 -0.599 . . . . 72.25 111.601 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.1 tt -131.23 109.09 15.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 CA-C-O 121.9 0.857 . . . . 73.53 108.747 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -107.71 152.07 24.82 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.49 -0.777 . . . . 75.33 110.651 -175.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 134.36 87.34 0.28 Allowed Glycine 0 N--CA 1.428 -1.896 0 C-N-CA 120.597 -0.811 . . . . 74.13 111.118 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.9 t -147.45 102.7 3.48 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.74 -0.467 . . . . 72.34 109.74 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 10.1 t -128.42 119.07 24.25 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.522 -0.918 . . . . 63.13 108.522 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -109.9 109.72 20.44 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.638 0.732 . . . . 61.32 110.832 -179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.22 109.3 20.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.807 -1.553 . . . . 63.34 106.807 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.24 -47.53 68.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.075 0.95 . . . . 73.14 113.552 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.3 mttm 60.34 70.05 0.65 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.89 0.876 . . . . 74.12 111.296 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -93.17 108.6 20.18 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.244 -1.021 . . . . 74.43 108.244 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.529 ' O ' HG23 ' A' ' 16' ' ' VAL . 6.5 p-10 -79.17 -6.29 56.21 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.514 0.931 . . . . 75.51 113.514 -172.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.0 m -39.48 114.89 0.45 Allowed 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 114.827 1.418 . . . . 55.21 114.827 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 14' ' ' ASP . 59.5 t -134.08 116.16 22.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 106.434 -1.691 . . . . 74.51 106.434 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.0 t -134.42 127.84 50.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.845 0 CA-C-O 120.611 0.243 . . . . 75.55 110.762 -177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -111.15 169.26 8.9 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.125 -0.694 . . . . 71.14 109.125 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.48 66.91 0.27 Allowed Glycine 0 C--N 1.303 -1.281 0 N-CA-C 111.001 -0.84 . . . . 74.44 111.001 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -139.63 136.18 34.06 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 109.578 -0.527 . . . . 61.02 109.578 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.6 t -175.74 153.0 1.34 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.139 -1.06 . . . . 71.41 108.139 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.3 m -104.95 82.96 1.93 Allowed 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.286 0.565 . . . . 63.24 109.969 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.6 m -100.59 57.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.364 0 CA-C-O 122.274 1.035 . . . . 62.14 111.456 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -170.8 147.9 2.83 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 106.299 -1.741 . . . . 72.41 106.299 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.4 166.63 14.69 Favored 'General case' 0 N--CA 1.423 -1.811 0 CA-C-O 121.167 0.508 . . . . 71.45 110.283 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.516 ' OG ' ' HA3' ' A' ' 158' ' ' GLY . 40.5 t -73.02 170.39 14.96 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 108.504 -0.925 . . . . 71.53 108.504 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.82 -23.47 60.78 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 64.45 109.505 -178.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -74.83 -47.48 30.28 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 106.795 -1.557 . . . . 73.21 106.795 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HB3' ' A' ' 32' ' ' ASP . 33.6 mm-40 -70.13 -20.74 63.15 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 114.852 -1.067 . . . . 73.21 111.611 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -68.84 -50.85 46.44 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 123.676 0.79 . . . . 64.13 109.026 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 12.9 tt -73.2 -30.18 30.42 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-O 121.57 0.7 . . . . 72.14 109.369 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HB3' ' HA ' ' A' ' 29' ' ' GLU . 31.8 t70 -63.81 -38.56 91.55 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.182 -0.917 . . . . 34.35 110.187 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 90.2 t90 -68.79 -41.09 79.22 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 123.741 0.651 . . . . 74.13 110.021 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.53 -38.42 91.07 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.357 -0.609 . . . . 55.14 109.357 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.31 65.77 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.996 -0.547 . . . . 40.52 110.545 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -72.92 -34.3 66.52 Favored 'General case' 0 C--O 1.2 -1.506 0 C-N-CA 122.556 0.342 . . . . 54.34 110.46 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.497 HH22 HD23 ' A' ' 42' ' ' LEU . 3.5 tpm_? -55.64 -35.67 66.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.626 0.727 . . . . 74.34 109.208 175.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -80.09 -38.34 31.89 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.789 -1.096 . . . . 65.32 111.546 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.2 m -94.7 20.4 8.69 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 113.88 1.067 . . . . 60.35 113.88 -173.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.42 125.46 14.48 Favored 'General case' 0 N--CA 1.425 -1.705 0 N-CA-C 108.458 -0.941 . . . . 71.32 108.458 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -102.47 154.33 19.2 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 109.445 -0.576 . . . . 64.0 109.445 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -103.82 53.64 0.75 Allowed 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.191 0.996 . . . . 74.14 109.088 -177.481 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 4.9 m -56.52 -25.27 51.23 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 113.378 -1.737 . . . . 71.4 112.289 -175.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -71.4 -11.99 61.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.402 0.62 . . . . 65.31 111.529 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -111.47 120.5 42.36 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.433 -0.951 . . . . 64.21 108.433 175.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.53 126.83 32.18 Favored 'General case' 0 CA--C 1.495 -1.164 0 N-CA-C 107.45 -1.315 . . . . 65.1 107.45 172.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.667 HG21 ' HG3' ' A' ' 99' ' ' ARG . 33.3 p -92.46 77.67 5.05 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 122.431 1.11 . . . . 74.44 113.433 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.9 m -85.32 102.94 13.8 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 114.675 -1.148 . . . . 42.13 108.236 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 52.89 70.97 0.52 Allowed 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 114.858 1.429 . . . . 63.11 114.858 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 14.3 m0 -80.79 107.76 13.87 Favored 'General case' 0 C--N 1.281 -2.371 0 N-CA-C 108.905 -0.776 . . . . 74.03 108.905 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.428 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 1.7 m-20 -94.3 63.26 3.04 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 108.608 -0.886 . . . . 73.4 108.608 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.4 m -82.6 -51.39 7.8 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 114.899 -1.046 . . . . 44.22 108.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.32 -36.82 61.68 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.218 -0.901 . . . . 72.42 111.064 174.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 32.4 tt0 -67.48 -42.98 82.09 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.675 -0.693 . . . . 74.44 110.865 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -69.74 -36.95 76.26 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.97 -0.559 . . . . 70.34 110.566 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.452 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.4 m -73.12 -29.75 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.308 0 C-N-CA 119.635 -0.826 . . . . 73.42 110.872 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -75.02 -19.78 59.9 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.163 0.506 . . . . 73.42 110.802 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.45 -48.78 54.29 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.585 -0.895 . . . . 60.23 108.585 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -82.84 -27.1 31.08 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.125 1.157 . . . . 74.32 114.125 -178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -124.91 20.08 8.4 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 114.258 1.207 . . . . 72.13 114.258 -174.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.7 m120 68.95 179.43 0.24 Allowed 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.137 0.575 . . . . 74.42 111.489 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.08 -11.41 39.36 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.887 0.699 . . . . 72.03 112.887 -178.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -71.05 -13.92 62.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.238 0.542 . . . . 54.42 110.874 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.674 ' O ' HG12 ' A' ' 67' ' ' ILE . . . -90.3 14.03 13.83 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.786 -0.643 . . . . 74.2 110.97 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.8 p -59.73 126.07 16.85 Favored 'Isoleucine or valine' 0 C--O 1.252 1.215 0 CA-C-O 121.87 0.843 . . . . 42.01 112.651 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 73.87 38.04 49.83 Favored Glycine 0 N--CA 1.432 -1.622 0 CA-C-N 114.23 -1.35 . . . . 63.3 113.301 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 64' ' ' ALA . 17.0 mm -60.59 -44.85 97.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 CA-C-N 117.729 0.765 . . . . 54.25 111.861 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 11.6 pt-20 -60.93 -41.54 96.4 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 112.983 0.734 . . . . 32.01 112.983 -176.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 p -84.08 -35.72 23.54 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.885 0.374 . . . . 72.24 111.455 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 29.5 tpt85 -77.61 -32.03 53.28 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.294 -0.412 . . . . 73.54 110.654 -175.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.01 -26.59 56.83 Favored 'General case' 0 C--O 1.204 -1.313 0 C-N-CA 119.935 -0.706 . . . . 65.2 111.517 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 92.2 mt -67.42 -36.31 80.99 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 109.304 -0.628 . . . . 62.03 109.304 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.74 -42.35 91.09 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.956 -0.565 . . . . 42.53 111.03 174.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' ARG . 75.5 mt -67.28 -36.41 76.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.289 -0.634 . . . . 74.14 109.289 176.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.4 -33.03 74.8 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 115.879 -0.601 . . . . 65.44 110.431 176.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -61.49 -39.95 92.77 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.401 -0.592 . . . . 72.41 109.401 172.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LYS . 45.8 mt-10 -67.57 -35.76 79.62 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.047 0.451 . . . . 64.24 110.77 176.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.55 -29.81 66.37 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.163 0.506 . . . . 70.21 110.52 172.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -68.16 -38.88 82.57 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.367 -0.975 . . . . 75.11 108.367 176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 77' ' ' GLU . 54.0 mmtt -55.35 -49.91 71.03 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.39 -0.596 . . . . 75.41 109.39 171.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.27 -44.85 95.58 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.956 -0.565 . . . . 73.11 111.093 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -69.81 -31.76 69.83 Favored 'General case' 0 C--O 1.209 -1.06 0 C-N-CA 120.959 -0.297 . . . . 62.42 111.533 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.43 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 53.6 p -71.77 -31.37 66.56 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.493 0.663 . . . . 63.34 110.828 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' LYS . 88.0 t -79.86 -32.47 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 115.82 -0.627 . . . . 73.52 110.269 176.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.9 tp -84.72 -55.83 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.32 0.648 . . . . 73.12 112.691 -177.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 164' ' ' LEU . 77.7 m -87.0 149.02 25.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 122.443 0.297 . . . . 74.01 111.315 -175.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.0 t -86.61 132.74 33.81 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-O 121.395 0.617 . . . . 60.11 111.999 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.99 3.14 83.24 Favored Glycine 0 CA--C 1.494 -1.238 0 CA-C-N 115.508 -0.769 . . . . 75.11 112.736 175.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.43 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 62.9 t -94.01 113.33 28.47 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.614 0 N-CA-C 107.634 -1.247 . . . . 64.44 107.634 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -94.24 141.84 28.1 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.835 -0.802 . . . . 62.01 108.835 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.401 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 9.0 pt-20 -70.21 -3.58 17.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.112 0.782 . . . . 74.43 113.112 -176.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.2 p -108.55 98.03 26.25 Favored Pre-proline 0 C--N 1.286 -2.155 0 CA-C-N 116.202 -0.454 . . . . 64.23 109.864 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 91' ' ' GLU . 7.5 Cg_endo -84.96 149.29 10.83 Favored 'Trans proline' 0 N--CA 1.44 -1.669 0 C-N-CA 122.466 2.111 . . . . 54.11 110.778 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -87.65 -38.08 16.2 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 109.181 -0.674 . . . . 43.44 109.181 -178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -102.38 97.72 7.93 Favored 'General case' 0 C--O 1.197 -1.696 0 N-CA-C 108.414 -0.958 . . . . 72.3 108.414 177.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.87 124.27 50.79 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 N-CA-C 107.414 -1.328 . . . . 61.22 107.414 173.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.32 137.7 58.3 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 123.546 0.529 . . . . 40.3 110.893 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -96.31 -25.53 15.73 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 116.006 -0.543 . . . . 72.34 111.641 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.5 mmt180 -135.61 139.56 43.92 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.054 0.454 . . . . 65.44 112.094 -174.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 59.2 t -104.42 117.97 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 106.611 -1.626 . . . . 63.22 106.611 171.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.421 ' HA ' ' CZ3' ' A' ' 50' ' ' TRP . 1.5 m -62.04 142.5 95.34 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.884 -0.784 . . . . 61.35 108.884 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 99.8 Cg_exo -48.55 -40.81 37.55 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.93 2.42 . . . . 74.44 112.743 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.97 -41.7 71.0 Favored Glycine 0 C--N 1.306 -1.116 0 CA-C-N 115.493 -0.776 . . . . 63.34 111.644 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -67.47 -34.31 76.92 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 109.986 -0.376 . . . . 72.33 109.986 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.55 -47.75 84.79 Favored 'General case' 0 CA--C 1.502 -0.892 0 C-N-CA 123.495 0.718 . . . . 71.41 110.504 179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.2 mt -61.9 -39.31 83.09 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 109.691 -0.485 . . . . 74.44 109.691 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 111' ' ' VAL . 20.0 m -63.92 -44.74 91.97 Favored 'General case' 0 N--CA 1.434 -1.265 0 CA-C-N 115.627 -0.715 . . . . 73.21 109.949 176.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.469 ' SD ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 mtp -59.91 -43.06 95.1 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 122.283 0.233 . . . . 62.42 111.616 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.54 -38.84 91.57 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.372 -0.531 . . . . 61.51 110.88 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -67.51 -43.16 81.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.228 -0.442 . . . . 74.11 110.964 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 107' ' ' SER . 96.1 t -62.42 -37.71 79.43 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.195 0 C-N-CA 122.851 0.46 . . . . 52.13 110.806 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.65 -22.8 67.09 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.161 0.505 . . . . 71.12 111.53 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.4 t -85.09 -41.41 15.76 Favored 'General case' 0 N--CA 1.421 -1.916 0 N-CA-C 109.29 -0.633 . . . . 64.34 109.29 176.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 50.9 mm -67.18 -47.22 82.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 116.025 -0.534 . . . . 53.5 110.075 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.9 p -65.15 -28.51 69.46 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.852 0.358 . . . . 71.11 111.655 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -73.46 -26.82 61.09 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 120.012 -0.675 . . . . 75.25 109.262 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.7 ttt180 -70.01 -46.1 65.82 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.012 -0.54 . . . . 73.53 109.788 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -67.94 -40.5 83.29 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 119.016 -1.074 . . . . 72.12 111.431 174.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.15 -39.67 93.39 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.313 0.486 . . . . 73.52 112.313 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.5 p -71.1 -38.05 72.37 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.602 -0.439 . . . . 72.04 110.84 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 29.3 t -68.31 -40.98 81.52 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.239 0.543 . . . . 73.01 109.552 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.7 tt -61.23 -48.48 81.29 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.221 -0.9 . . . . 75.2 109.376 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -65.42 -39.0 91.58 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.953 -0.567 . . . . 64.55 109.739 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -64.56 -47.07 80.14 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.255 -0.429 . . . . 73.42 111.736 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 128' ' ' GLU . 28.8 mtpp -79.48 -29.02 41.5 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 119.486 -0.886 . . . . 71.21 111.995 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 11.2 mt -67.29 -43.13 88.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 110.142 -0.318 . . . . 64.24 110.142 175.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.75 -34.83 79.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.258 0.551 . . . . 65.43 109.612 177.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.49 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 40.7 tt0 -57.87 -55.62 32.5 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.671 -1.149 . . . . 73.41 110.284 177.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.529 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.386 1.6 p90 -80.53 -18.51 48.25 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 114.879 1.437 . . . . 70.01 114.879 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -66.96 -30.27 70.35 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.712 -1.218 . . . . 71.33 107.712 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -81.25 -20.86 40.06 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-N 115.524 -0.762 . . . . 71.14 111.188 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 85.6 t -69.5 128.75 33.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 108.293 -1.003 . . . . 71.01 108.293 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.603 ' HA ' HG12 ' A' ' 141' ' ' VAL . 52.4 pttt -108.45 -172.0 1.97 Allowed 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.083 -0.962 . . . . 71.22 110.538 -173.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 106.57 0.75 Allowed 'General case' 0 C--O 1.249 1.064 0 CA-C-O 121.788 0.804 . . . . 65.11 109.939 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.425 ' HB3' ' HB ' ' A' ' 139' ' ' THR . 48.3 t -108.05 149.59 28.23 Favored 'General case' 0 N--CA 1.411 -2.385 0 CA-C-N 114.585 -1.189 . . . . 75.21 108.197 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -70.68 -12.56 61.63 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.276 0.56 . . . . 62.41 111.263 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -85.71 33.09 0.58 Allowed 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.895 -1.048 . . . . 74.5 109.484 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 60.88 41.93 99.43 Favored Glycine 0 N--CA 1.44 -1.051 0 CA-C-N 115.128 -0.942 . . . . 73.02 113.233 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.425 ' HB ' ' HB3' ' A' ' 135' ' ' SER . 7.4 m -125.74 132.3 52.36 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.008 -0.738 . . . . 75.42 109.008 176.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -98.19 -177.71 3.81 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 107.765 -1.198 . . . . 71.43 107.765 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.5 m -74.97 139.27 19.41 Favored 'Isoleucine or valine' 0 C--O 1.267 1.982 0 N-CA-C 104.651 -2.352 . . . . 72.31 104.651 170.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.529 HG13 ' HB2' ' A' ' 129' ' ' TRP . 19.7 mm -84.66 94.95 3.92 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 C-N-CA 118.009 -1.476 . . . . 54.21 109.536 -178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.8 tm0? -102.7 -23.8 13.8 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.352 -1.295 . . . . 42.31 109.851 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -122.67 153.67 39.08 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.969 -0.382 . . . . 74.22 109.969 -177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.469 ' O ' ' HB ' ' A' ' 150' ' ' THR . 12.1 tt -73.63 -24.38 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 CA-C-O 121.092 0.472 . . . . 74.03 111.804 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -90.89 25.92 2.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.099 0.476 . . . . 61.23 111.997 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.509 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.3 t70 -80.64 154.49 27.34 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.503 -1.295 . . . . 55.12 107.503 178.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -53.02 -40.23 63.71 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 124.617 1.167 . . . . 54.43 111.596 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -76.56 -38.38 55.09 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.993 -0.549 . . . . 75.13 110.793 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.509 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 0.3 OUTLIER -71.17 -42.87 68.54 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.571 -0.899 . . . . 72.04 108.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.522 ' O ' HG22 ' A' ' 155' ' ' VAL . 42.6 t-20 -53.94 -47.18 71.53 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.928 1.291 . . . . 62.24 109.393 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 71.5 m -60.3 -32.0 70.79 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.72 0.637 . . . . 64.35 112.72 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 92.1 t90 -78.41 -46.11 20.68 Favored 'General case' 0 CA--C 1.491 -1.303 0 C-N-CA 120.224 -0.59 . . . . 74.34 109.902 175.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.452 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.8 m-85 -61.28 -46.5 90.07 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.582 -0.735 . . . . 74.45 112.2 -175.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.522 HG22 ' O ' ' A' ' 151' ' ' ASN . 17.7 m -65.29 -33.43 63.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 112.962 0.727 . . . . 72.24 112.962 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -77.98 -24.51 48.03 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.377 0.608 . . . . 65.21 111.186 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.4 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 4.7 t-80 -90.0 -9.87 47.05 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.627 -0.715 . . . . 63.03 112.154 -176.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . 0.516 ' HA3' ' OG ' ' A' ' 26' ' ' SER . . . 118.5 3.71 14.17 Favored Glycine 0 CA--C 1.504 -0.607 0 C-N-CA 119.197 -1.477 . . . . 43.35 114.295 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.452 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 44.2 m-85 -99.77 115.52 29.73 Favored 'General case' 0 N--CA 1.427 -1.612 0 CA-C-N 117.06 0.43 . . . . 73.23 110.528 -178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -78.29 139.33 38.87 Favored 'General case' 0 C--N 1.284 -2.242 0 N-CA-C 106.358 -1.719 . . . . 52.42 106.358 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.5 t -64.66 -31.28 53.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.289 0.566 . . . . 43.31 110.272 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -71.93 -8.92 57.29 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.872 -0.604 . . . . 74.4 111.846 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -94.8 -24.39 17.09 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.111 0.564 . . . . 72.04 111.24 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 86' ' ' CYS . 4.5 pp -103.06 150.99 23.04 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.745 -0.382 . . . . 72.44 111.441 -177.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -103.96 175.78 5.37 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.383 -0.527 . . . . 64.04 111.709 -176.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -81.61 112.52 18.89 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 115.373 -0.83 . . . . 72.4 111.22 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.3 p -144.96 152.59 14.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.782 -1.192 . . . . 53.23 107.782 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 34.1 p -73.86 144.79 45.31 Favored 'General case' 0 N--CA 1.416 -2.16 0 CA-C-O 121.021 0.438 . . . . 71.31 109.928 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.473 HD22 HG22 ' A' ' 142' ' ' ILE . 21.8 tp -65.94 -34.24 77.67 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.35 -0.841 . . . . 65.24 109.299 -175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -71.93 -36.27 69.88 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.454 -0.794 . . . . 64.04 110.568 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.463 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.7 tttt -73.03 -38.04 66.69 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 119.309 -0.956 . . . . 71.12 109.412 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.23 -42.48 96.54 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.978 -0.749 . . . . 72.41 108.978 177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.7 96.31 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.98 -0.555 . . . . 55.54 111.998 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 14.7 t -74.68 -27.2 60.3 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.673 -0.811 . . . . 74.43 111.201 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 171' ' ' LYS . 93.1 t -70.22 -46.95 69.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.833 -0.432 . . . . 70.42 109.833 175.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.23 -36.32 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 C-N-CA 119.955 -0.698 . . . . 63.25 110.33 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -63.58 -37.9 89.07 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.271 -0.422 . . . . 72.35 110.586 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.49 -42.05 79.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 110.053 -0.351 . . . . 70.41 110.053 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 57.0 tp -63.23 -43.3 98.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.701 -0.682 . . . . 74.32 111.698 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.7 -16.03 12.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 N-CA-C 112.262 0.468 . . . . 52.25 112.262 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 48.2 m -103.27 1.41 32.86 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 113.577 0.955 . . . . 64.55 113.577 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.454 ' CE1' ' HB2' ' A' ' 185' ' ' MET 0.254 10.4 p80 -82.41 133.02 35.21 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 117.316 -1.753 . . . . 70.02 109.986 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -55.43 -26.39 41.6 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 114.444 1.276 . . . . 61.41 114.444 -171.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.443 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 19.2 t70 -74.21 -44.76 51.98 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.578 -0.449 . . . . 74.52 110.769 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . 0.454 ' HB2' ' CE1' ' A' ' 182' ' ' HIS . 0.2 OUTLIER -66.67 -39.99 88.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.857 -1.164 . . . . 71.33 107.857 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 71.6 mt -57.32 -43.96 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 114.999 -1.0 . . . . 73.43 110.407 178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -65.35 -41.82 93.46 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 119.378 -0.929 . . . . 60.21 111.054 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.415 ' O ' ' HB2' ' A' ' 192' ' ' MET . 1.7 mp -63.44 -43.67 98.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 C-N-CA 120.488 -0.485 . . . . 72.14 111.117 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -74.39 -31.82 62.5 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.7 -0.4 . . . . 73.2 111.61 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -79.46 -34.94 41.08 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.837 0.351 . . . . 71.31 110.952 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -70.39 -35.75 73.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 108.903 -0.777 . . . . 72.5 108.903 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.725 ' SD ' HG13 ' A' ' 196' ' ' VAL . 0.0 OUTLIER -77.28 -18.78 57.29 Favored 'General case' 0 C--O 1.193 -1.917 0 CA-C-N 115.793 -0.639 . . . . 63.15 109.749 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.454 ' NZ ' ' HB2' ' A' ' 193' ' ' LYS . 0.0 OUTLIER -66.07 -42.11 89.84 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.865 -1.161 . . . . 72.41 107.865 175.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -73.28 -36.63 66.35 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.74 -1.118 . . . . 72.3 109.849 175.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.404 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 2.5 t-20 -65.14 -41.9 94.35 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.259 -0.428 . . . . 74.0 110.696 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.725 HG13 ' SD ' ' A' ' 192' ' ' MET . 15.6 m -69.07 -34.13 62.17 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.929 0 C-N-CA 120.111 -0.635 . . . . 70.04 110.753 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.29 -44.96 86.3 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.544 0.687 . . . . 74.34 110.213 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.94 -45.68 91.35 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.515 -1.22 . . . . 71.1 110.178 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -74.28 -29.44 61.66 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 116.071 -0.513 . . . . 75.12 112.153 -178.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 22.4 p -75.42 -36.67 60.76 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 120.401 -0.519 . . . . 74.34 110.618 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -66.27 -39.67 89.58 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 119.969 -0.692 . . . . 72.05 110.355 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 206' ' ' ARG . 37.5 tt0 -64.74 -47.92 76.49 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 116.154 -0.475 . . . . 73.21 109.866 176.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -66.86 -34.8 78.6 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.806 -0.634 . . . . 62.11 110.924 -177.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 53.4 m -72.15 -38.61 69.17 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 121.209 -0.196 . . . . 62.15 110.721 177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -62.38 -47.62 83.36 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 110.077 -0.342 . . . . 71.24 110.077 178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 202' ' ' GLU . 10.6 ptm180 -71.58 -29.87 65.2 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 116.026 -0.533 . . . . 74.14 111.086 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 52.5 tp -71.05 -43.39 67.92 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 110.242 -0.281 . . . . 50.2 110.242 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -67.17 -40.55 86.62 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.269 0.557 . . . . 73.11 109.824 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 46.9 ttp -69.57 -31.69 70.02 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.739 -0.664 . . . . 72.2 110.224 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 16.2 tpt -72.84 -33.91 66.45 Favored 'General case' 0 C--O 1.208 -1.107 0 N-CA-C 109.359 -0.608 . . . . 64.44 109.359 176.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . 0.465 ' HA ' ' HB ' ' A' ' 215' ' ' ILE . . . -63.3 -38.38 90.92 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 122.572 0.349 . . . . 63.44 110.564 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 45.5 mt-10 -69.26 -42.61 75.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.915 -0.584 . . . . 75.45 110.751 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -66.7 -46.29 76.06 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 64.3 111.144 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 149.93 89.99 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.556 0 N-CA-C 110.106 -1.198 . . . . 62.41 110.106 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . 0.465 ' HB ' ' HA ' ' A' ' 211' ' ' ALA . 7.6 tp -82.11 131.61 33.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 121.112 0.482 . . . . 75.2 109.79 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 46.1 m -84.69 102.52 13.03 Favored 'General case' 0 N--CA 1.413 -2.276 0 CA-C-N 115.828 -0.623 . . . . 50.45 110.771 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -75.75 98.92 1.21 Allowed Glycine 0 N--CA 1.43 -1.705 0 N-CA-C 109.05 -1.62 . . . . 74.33 109.05 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -77.95 101.59 6.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.172 0.51 . . . . 65.22 110.932 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -86.59 127.28 34.9 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 108.482 -0.933 . . . . 62.11 108.482 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -107.57 -113.11 3.7 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 119.923 -1.132 . . . . 75.55 112.359 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -168.87 -175.19 2.3 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 105.854 -1.906 . . . . 62.32 105.854 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -82.31 115.64 21.46 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 106.805 -1.554 . . . . 64.03 106.805 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.29 -1.998 0 CA-C-O 117.931 -1.033 . . . . 65.23 108.985 179.332 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.441 -0.906 0 N-CA-C 109.122 -0.695 . . . . 71.22 109.122 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 t -150.97 96.24 2.3 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 109.04 -0.726 . . . . 55.23 109.04 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.45 -179.92 30.94 Favored Glycine 0 N--CA 1.437 -1.25 0 N-CA-C 109.235 -1.546 . . . . 63.43 109.235 177.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.8 tp -127.39 110.66 23.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 CA-C-O 121.577 0.703 . . . . 71.02 110.34 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.4 140.78 30.47 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.504 -0.771 . . . . 73.42 109.823 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.48 -36.46 0.09 OUTLIER Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 121.08 -0.581 . . . . 61.44 111.723 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -65.2 94.34 0.15 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.788 0.804 . . . . 70.41 111.716 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.4 m -108.64 5.17 24.68 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 122.886 1.327 . . . . 72.25 108.397 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -151.59 150.4 30.27 Favored 'General case' 0 C--N 1.287 -2.133 0 CA-C-N 113.725 -1.58 . . . . 74.45 106.931 -175.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -79.49 153.72 29.39 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.63 -0.878 . . . . 73.23 108.63 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -83.73 -19.8 34.55 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 120.888 0.375 . . . . 64.33 111.074 -176.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 53.56 59.68 4.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 122.765 1.269 . . . . 74.01 111.619 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -144.36 179.81 7.01 Favored 'General case' 0 CA--C 1.483 -1.631 0 N-CA-C 105.605 -1.998 . . . . 71.21 105.605 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.27 -19.59 65.52 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-O 121.142 0.496 . . . . 73.5 110.165 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.2 m 73.82 103.8 0.07 Allowed 'General case' 0 C--O 1.243 0.755 0 C-N-CA 125.219 1.408 . . . . 73.22 111.88 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -93.2 105.86 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.884 -1.053 . . . . 74.41 110.634 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.0 t -96.92 106.61 18.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.863 0 N-CA-C 107.794 -1.188 . . . . 62.51 107.794 178.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.14 103.41 14.9 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.441 -1.318 . . . . 52.04 107.441 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.95 51.3 0.67 Allowed Glycine 0 N--CA 1.422 -2.29 0 N-CA-C 110.066 -1.214 . . . . 74.22 110.066 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.69 134.38 35.15 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.883 -0.414 . . . . 73.52 109.883 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.8 t -104.45 135.71 45.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.498 -0.927 . . . . 71.54 108.498 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.0 m -82.04 131.04 35.24 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 109.096 -0.705 . . . . 52.44 109.096 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.4 m -81.06 74.73 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-O 122.084 0.945 . . . . 73.02 113.331 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 178.35 161.98 0.65 Allowed 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 105.796 -1.928 . . . . 75.41 105.796 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . -123.22 148.36 45.92 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.774 0.321 . . . . 64.23 110.755 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.2 m -87.88 177.56 6.95 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 104.694 -2.336 . . . . 71.24 104.694 168.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' ND1' ' A' ' 157' ' ' HIS . 69.0 mt -65.34 -21.11 66.66 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 113.34 0.867 . . . . 74.44 113.34 -177.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' SG ' ' A' ' 86' ' ' CYS . 0.3 OUTLIER -70.1 -56.67 6.31 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.477 -0.564 . . . . 71.34 109.477 175.077 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.7 mp0 -65.83 -23.81 66.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.542 -0.299 . . . . 70.25 111.128 179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -60.69 -43.08 98.19 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.984 -1.117 . . . . 62.44 107.984 176.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 27' ' ' LEU . 86.4 mt -59.81 -42.93 90.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.307 0 CA-C-N 114.939 -1.028 . . . . 61.3 109.25 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -61.59 -36.24 80.11 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.415 -0.811 . . . . 54.24 112.274 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.484 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 79.4 t90 -76.06 -40.67 52.77 Favored 'General case' 0 N--CA 1.428 -1.568 0 N-CA-C 109.14 -0.689 . . . . 71.32 109.14 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -61.45 -44.0 97.88 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 109.336 -0.616 . . . . 63.31 109.336 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.14 72.23 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.854 -0.612 . . . . 74.31 110.643 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.8 -47.9 76.39 Favored 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 109.426 -0.583 . . . . 73.45 109.426 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.9 -25.0 60.91 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 115.892 -0.595 . . . . 71.54 111.298 -168.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -88.51 -24.86 22.82 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 120.38 -0.528 . . . . 75.43 111.152 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.8 t -100.87 19.33 17.45 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 122.007 -0.433 . . . . 64.45 110.757 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -91.11 124.22 35.17 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-O 121.329 0.585 . . . . 64.43 111.078 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -84.76 148.44 26.35 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.985 -1.117 . . . . 74.32 107.985 174.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' ' 45' ' ' LYS 0.257 1.0 OUTLIER -117.87 66.66 0.75 Allowed 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.695 1.236 . . . . 62.25 112.29 -178.737 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.2 m -80.05 -30.12 39.36 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.156 -1.383 . . . . 53.01 110.416 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -92.42 -3.26 55.53 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.37 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 95.4 mttt -117.41 119.75 36.06 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 120.148 -0.621 . . . . 74.34 110.526 -176.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.93 131.99 35.55 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.358 -1.719 . . . . 64.43 106.358 176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.743 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -91.95 73.65 5.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 CA-C-O 123.069 1.414 . . . . 52.42 111.176 -176.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.0 m -82.34 86.78 6.64 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 113.724 -1.58 . . . . 73.53 110.015 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 46.99 72.6 0.23 Allowed 'General case' 0 C--O 1.246 0.878 0 C-N-CA 124.779 1.232 . . . . 64.52 113.635 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.647 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 27.7 m0 -76.01 106.98 7.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 115.104 -0.953 . . . . 73.51 108.766 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 91.3 m-20 -90.43 62.96 5.46 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.798 0.808 . . . . 64.31 110.769 -177.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 56' ' ' VAL . 7.3 m -74.89 -57.33 3.98 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.047 -0.979 . . . . 74.32 108.945 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -60.73 -29.99 69.71 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.212 -0.904 . . . . 74.21 110.903 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 31.3 tp10 -76.67 -34.69 58.22 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 116.301 -0.409 . . . . 65.32 110.623 -177.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.67 -37.37 42.02 Favored 'General case' 0 CA--C 1.503 -0.851 0 C-N-CA 120.287 -0.565 . . . . 75.13 110.62 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.458 HG23 ' HB1' ' A' ' 64' ' ' ALA . 28.1 m -73.36 -21.66 18.88 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.453 0 C-N-CA 119.732 -0.787 . . . . 74.35 110.231 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -61.59 -43.26 99.19 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 123.281 0.633 . . . . 74.44 109.902 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.29 -32.97 49.72 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.278 0.561 . . . . 75.44 111.568 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 92.4 mt -83.4 -27.07 29.85 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 113.375 0.88 . . . . 71.14 113.375 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.529 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.8 tt -120.81 -19.76 7.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 112.769 0.655 . . . . 73.14 112.769 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 60' ' ' LEU . 11.1 m120 90.66 -174.39 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.459 1.504 . . . . 73.21 111.68 -175.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 61' ' ' ASN . 1.5 mp0 -57.03 -14.69 3.94 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.568 1.147 . . . . 64.14 113.97 -172.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -64.84 -20.82 66.61 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 72.34 110.371 177.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB1' HG23 ' A' ' 56' ' ' VAL . . . -91.49 13.78 16.7 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 114.336 1.236 . . . . 64.34 114.336 -174.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 91.4 t -66.35 104.57 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-O 121.535 0.684 . . . . 74.23 110.775 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 82.79 77.34 1.09 Allowed Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.881 -0.888 . . . . 55.21 110.881 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 18.5 mm -100.44 -42.17 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 N-CA-C 112.296 0.48 . . . . 70.32 112.296 -178.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 0.3 OUTLIER -59.8 -42.47 93.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.979 0.419 . . . . 73.51 110.735 -179.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.8 p -70.63 -33.69 71.28 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.649 -0.705 . . . . 75.3 111.343 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 1.4 tpp180 -68.31 -46.44 70.24 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.153 -1.054 . . . . 73.01 108.153 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 89.2 mt -61.42 -39.67 91.6 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.037 -0.983 . . . . 72.24 110.334 -178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 96.9 mt -63.56 -44.22 94.75 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 123.394 0.434 . . . . 74.53 111.274 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.76 -35.13 74.66 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-O 121.084 0.468 . . . . 63.25 111.512 -177.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.6 mt -77.1 -37.04 25.61 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 115.88 -0.6 . . . . 74.22 109.981 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.5 96.88 Favored 'General case' 0 C--O 1.198 -1.645 0 CA-C-N 116.307 -0.406 . . . . 60.44 109.971 177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -53.94 -46.18 71.48 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 123.671 0.607 . . . . 54.23 110.673 174.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -64.25 -41.89 96.75 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.609 -0.723 . . . . 61.22 109.951 -177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -70.69 -36.0 73.06 Favored 'General case' 0 C--O 1.208 -1.112 0 C-N-CA 120.422 -0.511 . . . . 60.43 110.921 177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HE1' ' O ' ' A' ' 90' ' ' ASN . 56.3 t-80 -59.32 -46.13 89.43 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 123.946 0.898 . . . . 74.22 109.709 177.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -61.87 -41.64 98.1 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.034 -0.53 . . . . 75.53 111.543 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.07 -39.85 68.7 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 120.489 -0.484 . . . . 74.42 111.745 177.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -69.91 -27.33 64.7 Favored 'General case' 0 C--O 1.201 -1.498 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.912 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.2 t -67.43 -37.78 83.53 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.868 0.366 . . . . 75.51 111.03 175.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.59 -37.6 80.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 109.113 -0.699 . . . . 45.3 109.113 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 164' ' ' LEU . 5.1 tt -75.74 -55.19 5.88 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.742 -1.117 . . . . 74.02 110.584 -178.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 77.7 m -95.27 119.56 33.98 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 114.94 1.459 . . . . 70.31 114.94 -172.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.9 m -59.59 127.41 31.88 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 114.675 -1.148 . . . . 72.14 110.767 175.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 110.22 -13.76 31.04 Favored Glycine 0 CA--C 1.502 -0.75 0 C-N-CA 121.142 -0.551 . . . . 54.34 113.277 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 42.3 t -100.0 133.82 41.63 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 N-CA-C 108.687 -0.857 . . . . 74.25 108.687 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.419 ' O ' ' HE1' ' A' ' 79' ' ' HIS . 49.3 t-20 -99.36 142.64 30.57 Favored 'General case' 0 C--O 1.192 -1.93 0 N-CA-C 108.552 -0.907 . . . . 75.42 108.552 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -74.12 -5.7 43.24 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.396 0.678 . . . . 75.42 112.108 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 18.1 p -128.91 99.96 21.67 Favored Pre-proline 0 C--N 1.298 -1.667 0 CA-C-N 115.542 -0.753 . . . . 72.1 109.417 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -83.5 149.6 13.02 Favored 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.287 1.991 . . . . 75.25 111.445 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.9 -30.63 12.27 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.782 -0.821 . . . . 64.51 108.782 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -104.96 105.75 15.94 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 106.724 -1.584 . . . . 73.31 106.724 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 74.7 t -112.81 136.32 49.45 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.308 0 CA-C-N 115.658 -0.701 . . . . 71.11 110.819 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.03 135.4 52.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.757 -0.656 . . . . 71.34 110.239 176.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -107.45 -19.78 13.46 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.503 0.668 . . . . 75.33 111.068 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.743 ' HG3' HG21 ' A' ' 47' ' ' THR . 26.8 mmt180 -141.89 132.69 25.72 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.102 -0.499 . . . . 74.3 110.977 -171.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t -110.82 125.63 68.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.243 -1.762 . . . . 73.55 106.243 173.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 95.6 p -78.22 162.2 67.59 Favored Pre-proline 0 C--N 1.312 -1.034 0 CA-C-O 119.629 -0.224 . . . . 65.41 110.425 -175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.56 -31.09 91.89 Favored 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 122.413 2.076 . . . . 73.42 111.921 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -76.74 -45.55 12.71 Favored Glycine 0 C--N 1.314 -0.684 0 CA-C-N 115.666 -0.697 . . . . 73.41 111.737 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -71.86 -26.07 62.21 Favored 'General case' 0 CA--C 1.497 -1.094 0 CA-C-O 120.446 0.165 . . . . 61.05 111.14 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.609 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -59.76 -40.42 88.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.403 177.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.83 -42.53 96.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 123.504 0.503 . . . . 63.33 109.939 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.453 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -67.24 -43.73 81.22 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 109.509 -0.552 . . . . 44.34 109.509 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.2 tpt -63.17 -38.31 90.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.626 -0.715 . . . . 71.4 111.125 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 87.5 mt -62.65 -44.23 96.81 Favored 'General case' 0 CA--C 1.512 -0.518 0 N-CA-C 109.832 -0.433 . . . . 74.12 109.832 177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -67.57 -38.15 83.68 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.496 -0.482 . . . . 73.52 111.705 178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.484 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 76.7 t -63.28 -45.35 98.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 O-C-N 123.243 0.339 . . . . 41.2 110.514 177.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 73.1 mt -66.28 -32.42 73.82 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 121.055 -0.258 . . . . 71.22 111.395 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 47.2 m -65.07 -45.85 83.57 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.338 -0.615 . . . . 75.14 109.338 175.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 83.8 mt -62.97 -42.64 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 109.827 -0.434 . . . . 53.44 109.827 177.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.497 ' O ' ' HG3' ' A' ' 118' ' ' GLU . 45.6 m -62.92 -39.42 94.52 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.69 -0.687 . . . . 74.21 110.717 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -70.67 -34.01 71.54 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.317 -0.864 . . . . 74.23 109.683 -179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 113' ' ' SER . 78.9 mtp180 -69.67 -40.32 76.5 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.836 -0.62 . . . . 72.14 111.265 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 115' ' ' THR . 0.9 OUTLIER -65.61 -42.27 91.77 Favored 'General case' 0 C--O 1.193 -1.899 0 C-N-CA 120.38 -0.528 . . . . 74.33 111.463 178.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 119' ' ' LEU . 3.1 mm? -68.52 -34.49 75.96 Favored 'General case' 0 CA--C 1.51 -0.582 0 C-N-CA 119.26 -0.976 . . . . 53.33 112.021 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 26.9 m -69.57 -38.13 77.27 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 109.9 -0.407 . . . . 61.0 109.9 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 31.8 t -72.9 -38.63 66.84 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.214 -0.448 . . . . 71.22 109.842 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.59 -49.58 76.98 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.418 ' HA ' HG13 ' A' ' 126' ' ' ILE . 83.8 tttt -60.81 -43.11 98.62 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.256 -0.577 . . . . 72.42 110.551 -179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -63.95 -40.74 97.13 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.727 -0.669 . . . . 70.22 111.239 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.594 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 73.9 mmtt -74.23 -43.65 56.25 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 116.198 -0.456 . . . . 73.33 110.669 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.481 HG22 ' HE1' ' A' ' 129' ' ' TRP . 2.1 pp -70.13 -30.81 45.19 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 C-N-CA 119.994 -0.682 . . . . 42.04 111.283 -174.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -65.07 -35.69 81.95 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.317 0.386 . . . . 64.41 110.711 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.506 ' O ' ' HB3' ' A' ' 131' ' ' LYS . 35.2 tt0 -74.98 -41.15 60.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 119.55 -0.86 . . . . 75.4 111.751 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.594 ' CH2' ' HB3' ' A' ' 125' ' ' LYS 0.408 2.0 p90 -80.74 -18.54 47.43 Favored 'General case' 0 C--O 1.211 -0.941 0 C-N-CA 118.415 -1.314 . . . . 64.12 114.325 178.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -72.13 -21.31 61.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.994 0.902 . . . . 73.4 108.605 172.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 128' ' ' GLU . 59.1 tttp -76.79 -18.31 58.5 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.448 -1.251 . . . . 74.15 108.97 174.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 90.8 t -72.87 118.14 17.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 107.541 -1.281 . . . . 64.41 107.541 173.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.493 ' HA ' HG12 ' A' ' 141' ' ' VAL . 15.1 ptmm? -102.24 -177.96 3.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.697 -1.138 . . . . 71.1 112.754 -170.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.454 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -68.83 120.44 14.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-N 114.147 -1.388 . . . . 42.44 107.785 174.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.576 ' HB3' ' OG1' ' A' ' 139' ' ' THR . 37.7 t -129.16 163.3 25.85 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 115.838 -0.619 . . . . 72.23 109.898 -175.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -68.21 -13.65 62.39 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.025 0.75 . . . . 61.1 113.025 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -78.92 -9.26 59.45 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.244 0.545 . . . . 71.54 110.318 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 104.82 13.89 24.48 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.786 -0.721 . . . . 31.11 113.218 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.576 ' OG1' ' HB3' ' A' ' 135' ' ' SER . 0.1 OUTLIER -77.34 147.05 36.37 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.151 0.501 . . . . 64.2 110.839 177.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 41.5 tttm -114.14 151.39 32.72 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 115.025 -0.989 . . . . 71.11 108.487 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 133' ' ' LYS . 28.7 m -64.37 136.26 26.75 Favored 'Isoleucine or valine' 0 C--O 1.27 2.18 0 N-CA-C 108.825 -0.805 . . . . 72.14 108.825 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 129' ' ' TRP . 60.9 mt -82.78 91.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.444 0 CA-C-O 123.055 1.407 . . . . 70.23 110.439 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -117.12 -13.34 10.54 Favored 'General case' 0 C--N 1.292 -1.906 0 CA-C-N 112.779 -2.01 . . . . 73.1 109.524 -177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -111.6 149.11 31.94 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.294 -1.373 . . . . 71.33 107.294 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 14.0 tt -68.62 -24.99 29.76 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-O 120.993 0.425 . . . . 73.34 110.531 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -99.37 30.99 3.27 Favored 'General case' 0 C--O 1.252 1.216 0 CA-C-O 121.511 0.672 . . . . 73.23 111.421 -177.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.43 ' HB2' HG23 ' A' ' 142' ' ' ILE . 15.3 m-20 -77.57 155.07 31.76 Favored 'General case' 0 N--CA 1.427 -1.603 0 N-CA-C 108.89 -0.782 . . . . 74.41 108.89 176.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -56.03 -34.79 66.19 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 114.298 1.221 . . . . 55.12 114.298 -168.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 149' ' ' ARG . 0.0 OUTLIER -84.34 -32.57 24.19 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.186 -1.006 . . . . 74.12 109.057 -176.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.454 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -64.72 -48.02 76.17 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.683 -1.144 . . . . 72.41 108.222 177.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.431 ' O ' HG22 ' A' ' 155' ' ' VAL . 87.2 m-20 -55.14 -39.31 69.31 Favored 'General case' 0 CA--C 1.49 -1.329 0 C-N-CA 123.396 0.678 . . . . 71.51 110.747 178.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 58.0 m -60.32 -36.84 78.86 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 116.043 -0.526 . . . . 75.01 111.68 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 81.8 t90 -78.91 -40.33 32.5 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.096 -0.705 . . . . 73.35 109.096 178.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.454 ' HD1' ' O ' ' A' ' 150' ' ' THR . 21.0 m-85 -63.0 -48.34 79.24 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 114.968 -1.015 . . . . 74.2 111.808 -178.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.3 m -62.9 -38.18 81.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.18 0.437 . . . . 73.34 112.18 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.93 -34.76 79.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.361 0.601 . . . . 74.1 110.844 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.626 ' ND1' HD12 ' A' ' 27' ' ' LEU . 11.9 m170 -85.09 -6.38 59.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 114.171 1.175 . . . . 75.34 114.171 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.03 -10.83 17.8 Favored Glycine 0 CA--C 1.495 -1.212 0 C-N-CA 119.665 -1.255 . . . . 62.44 112.568 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 29.3 m-85 -69.32 113.88 7.06 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.533 0.682 . . . . 74.24 110.763 -176.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -78.86 135.83 37.14 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 106.464 -1.68 . . . . 74.1 106.464 175.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.65 -34.48 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-O 121.178 0.513 . . . . 75.43 110.911 -175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.07 -12.5 60.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.019 -0.537 . . . . 54.33 111.416 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 47.3 mt-10 -97.25 -0.83 46.03 Favored 'General case' 0 N--CA 1.428 -1.556 0 CA-C-N 116.592 -0.276 . . . . 61.04 111.506 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 4.6 pp -113.77 139.57 49.0 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.515 -0.474 . . . . 75.24 109.901 174.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -85.85 167.61 15.01 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.216 0.531 . . . . 71.45 112.112 -175.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.83 102.4 13.66 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.513 -0.767 . . . . 71.03 109.324 173.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 14.1 p -149.5 157.9 6.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 0 N-CA-C 107.385 -1.339 . . . . 74.21 107.385 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 11.7 p -70.64 142.73 51.61 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 121.804 0.811 . . . . 74.02 111.17 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.468 HD21 ' HB ' ' A' ' 126' ' ' ILE . 58.5 tp -76.55 -35.61 58.14 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.807 -1.088 . . . . 74.42 108.772 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -64.78 -43.35 93.51 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.221 -0.9 . . . . 75.41 110.564 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -67.48 -43.47 80.89 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 120.503 -0.479 . . . . 73.02 109.935 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.16 -44.44 92.1 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.261 -0.576 . . . . 73.24 109.865 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.91 82.27 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 116.338 -0.392 . . . . 64.44 111.717 -176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -70.7 -39.02 73.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 120.185 -0.606 . . . . 63.25 112.078 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 49.4 t -72.32 -41.44 65.59 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 C-N-CA 119.368 -0.933 . . . . 73.04 110.031 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.4 p -73.41 -33.33 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.309 0 C-N-CA 118.842 -1.143 . . . . 63.52 110.573 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.501 ' HA ' HG22 ' A' ' 180' ' ' VAL . 3.7 t-20 -64.99 -39.76 93.94 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 110.409 -0.219 . . . . 61.32 110.409 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -66.38 -40.6 89.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 120.307 -0.557 . . . . 73.14 109.797 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -71.79 -32.15 67.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 113.7 1.0 . . . . 64.43 113.7 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . 0.501 HG22 ' HA ' ' A' ' 177' ' ' ASN . 29.8 m -79.73 -15.64 13.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 121.21 -0.931 . . . . 70.11 110.904 177.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 23.0 t -113.31 16.77 18.93 Favored 'General case' 0 N--CA 1.414 -2.272 0 CA-C-N 116.334 -0.394 . . . . 50.22 111.554 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 186' ' ' ILE . 19.2 p80 -75.98 153.51 36.49 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 118.493 -1.283 . . . . 72.02 109.483 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -51.91 -48.9 63.95 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 113.982 1.104 . . . . 75.04 113.982 -173.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.77 -35.91 82.06 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.014 0.435 . . . . 73.35 111.119 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.8 tpt -69.59 -34.35 74.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.892 -0.594 . . . . 60.32 110.284 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 182' ' ' HIS . 46.0 mm -65.9 -41.35 89.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.125 -0.694 . . . . 64.32 109.125 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -65.08 -42.92 93.65 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.737 -0.665 . . . . 73.43 110.77 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.461 HG23 ' SD ' ' A' ' 192' ' ' MET . 1.7 mp -66.56 -43.63 90.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 116.054 -0.521 . . . . 74.43 110.743 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -65.02 -39.32 93.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.402 -0.363 . . . . 71.32 110.847 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.63 -45.15 94.16 Favored 'General case' 0 C--O 1.249 1.059 0 CA-C-O 121.319 0.581 . . . . 75.22 109.835 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.5 -40.5 93.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.904 -1.044 . . . . 72.3 110.863 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.461 ' SD ' HG23 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -64.81 -44.44 89.91 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.403 0.439 . . . . 53.31 110.429 177.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -62.75 -41.76 99.36 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.107 -0.497 . . . . 74.23 110.085 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.47 -32.36 69.87 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.243 0.544 . . . . 71.21 110.896 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.74 -45.41 64.89 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 116.029 -0.532 . . . . 63.42 109.876 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 29.4 m -73.42 -27.0 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 116.341 -0.39 . . . . 60.32 110.1 -178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.0 -49.26 73.16 Favored 'General case' 0 CA--C 1.504 -0.827 0 CA-C-N 115.679 -0.692 . . . . 74.51 109.358 175.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -62.66 -40.5 97.25 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.918 -0.583 . . . . 73.13 110.786 177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.9 m0 -69.41 -27.99 65.77 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.522 0.564 . . . . 73.12 112.522 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.6 m -68.59 -41.49 79.58 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.818 -0.808 . . . . 63.13 108.818 174.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.34 -41.33 94.0 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.264 -0.88 . . . . 73.1 109.943 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.45 -49.3 72.82 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 123.511 0.724 . . . . 75.51 110.736 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -59.6 -45.55 91.58 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.761 -0.654 . . . . 75.14 110.258 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 18.8 m -68.68 -38.97 80.77 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.37 -0.832 . . . . 50.55 110.824 -176.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -71.27 -37.95 71.87 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.282 -0.417 . . . . 72.32 110.682 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 210' ' ' MET . 33.0 ttm180 -71.89 -34.56 69.26 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 120.843 0.354 . . . . 73.22 110.364 -178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 50.8 tp -68.18 -43.6 77.78 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.307 -0.627 . . . . 71.23 109.307 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.78 -34.08 77.34 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 115.831 -0.622 . . . . 72.44 110.176 177.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 48.2 ttm -61.79 -46.67 88.55 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 123.806 0.842 . . . . 73.34 109.902 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 206' ' ' ARG . 25.9 mmt -64.65 -37.34 87.25 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.77 -0.65 . . . . 63.53 110.834 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.66 -35.22 72.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 74.55 110.751 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -67.76 -45.62 74.38 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.4 1.08 . . . . 73.22 108.643 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -68.76 -35.65 77.35 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.175 -0.92 . . . . 74.53 109.77 179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 89.85 24.48 29.94 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 110.512 -1.035 . . . . 72.23 110.512 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . 0.405 ' O ' ' HB3' ' A' ' 210' ' ' MET . 47.4 mm -127.44 117.42 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 N-CA-C 108.605 -0.887 . . . . 73.42 108.605 -176.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.8 t -90.07 90.62 8.21 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.556 -0.905 . . . . 73.54 108.556 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -139.22 49.53 0.82 Allowed Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 110.871 -0.891 . . . . 74.4 110.871 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -95.63 102.88 14.72 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.594 -0.521 . . . . 71.21 109.594 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -87.78 107.18 18.53 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-O 121.216 0.532 . . . . 65.34 110.207 -179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -101.97 19.83 47.91 Favored Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.526 -1.029 . . . . 74.2 110.526 177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 56.4 tptt -75.04 88.86 2.41 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 108.575 -0.898 . . . . 61.24 108.575 177.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.66 -58.75 3.55 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 114.373 -1.285 . . . . 52.14 108.857 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 22.5 t70 . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 106.202 -1.777 . . . . 71.52 106.202 177.746 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 107.32 -1.363 . . . . 74.42 107.32 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 p -80.53 156.41 26.52 Favored 'General case' 0 N--CA 1.433 -1.318 0 N-CA-C 109.023 -0.732 . . . . 73.13 109.023 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.41 159.29 28.35 Favored Glycine 0 N--CA 1.424 -2.126 0 C-N-CA 119.314 -1.422 . . . . 74.34 112.124 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.1 pt -88.35 97.16 6.49 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.192 0 CA-C-O 122.254 1.026 . . . . 74.54 108.882 177.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -97.63 109.96 22.62 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 114.677 -1.147 . . . . 64.4 108.672 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -79.46 142.63 25.06 Favored Glycine 0 N--CA 1.43 -1.725 0 N-CA-C 110.148 -1.181 . . . . 63.25 110.148 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.62 121.69 30.37 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 109.526 -0.546 . . . . 64.43 109.526 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.9 t -88.84 106.62 18.5 Favored 'General case' 0 N--CA 1.415 -2.181 0 CA-C-O 122.267 1.032 . . . . 51.33 108.808 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -105.3 150.75 24.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.257 -0.883 . . . . 74.2 110.965 -175.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.672 ' OD2' ' HG3' ' A' ' 12' ' ' LYS . 9.5 t70 -153.13 144.07 22.91 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 115.452 -0.795 . . . . 63.33 109.956 -176.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -83.03 -58.23 2.95 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.984 0.735 . . . . 73.43 112.984 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.672 ' HG3' ' OD2' ' A' ' 10' ' ' ASP . 62.3 mttp 55.36 60.55 3.32 Favored 'General case' 0 C--O 1.246 0.915 0 CA-C-O 121.795 0.807 . . . . 73.23 111.338 -167.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -86.57 122.56 30.67 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 107.629 -1.248 . . . . 63.13 107.629 176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -95.06 -49.71 5.41 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-N 116.239 -0.437 . . . . 72.13 111.396 -175.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 19.4 m 59.49 81.71 0.16 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.027 0.918 . . . . 63.33 109.752 -175.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.14 113.52 35.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 CA-C-O 121.807 0.813 . . . . 71.0 112.82 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -96.08 129.51 46.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.669 0 N-CA-C 107.965 -1.124 . . . . 74.32 107.965 174.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -82.29 130.46 35.1 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.234 -0.654 . . . . 72.02 109.234 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -109.52 47.53 1.03 Allowed Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 120.697 -0.763 . . . . 74.24 112.257 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.27 138.27 31.59 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.191 -0.67 . . . . 75.41 109.191 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 31.0 m -147.86 143.97 27.8 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.078 -1.082 . . . . 73.13 108.078 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 23.3 m -99.39 99.56 10.5 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.022 -0.732 . . . . 62.44 109.022 176.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.1 p -79.08 129.07 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 N-CA-C 109.331 -0.618 . . . . 61.43 109.331 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 70.13 170.02 0.31 Allowed 'General case' 0 N--CA 1.436 -1.135 0 CA-C-O 121.778 0.799 . . . . 73.51 110.814 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.34 164.28 13.28 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 115.425 -0.807 . . . . 72.24 109.212 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.1 p -81.44 178.59 8.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.778 -1.193 . . . . 43.12 107.778 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB3' ' OE1' ' A' ' 118' ' ' GLU . 2.9 mm? -75.95 -27.89 57.71 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.866 0.841 . . . . 70.11 109.138 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' C ' ' HD3' ' A' ' 28' ' ' LYS . 11.5 tmtt? -73.89 -39.1 64.15 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.503 -0.925 . . . . 74.15 108.503 178.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.09 -21.22 61.53 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.907 -0.588 . . . . 75.2 111.405 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -67.81 -51.3 50.22 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.732 -0.84 . . . . 71.31 108.732 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.9 pt -73.12 -28.75 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 CA-C-O 121.524 0.678 . . . . 72.31 110.215 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.89 -41.13 75.14 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 115.427 -0.806 . . . . 63.14 110.787 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.0 t90 -67.85 -36.98 81.26 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 110.067 -0.346 . . . . 74.11 110.067 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.54 -46.08 91.47 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.159 0.504 . . . . 32.3 109.892 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.65 -31.6 69.77 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.701 -0.681 . . . . 74.32 110.824 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -70.11 -32.57 70.68 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.674 0.789 . . . . 70.04 109.961 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 16.3 tpt180 -69.42 -40.84 77.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.945 -0.761 . . . . 64.34 108.945 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -69.67 -23.81 63.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.862 -0.608 . . . . 72.22 110.729 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 42.6 t -92.69 11.88 25.25 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 115.501 -0.772 . . . . 52.32 111.23 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -104.96 124.71 49.98 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 121.799 -0.563 . . . . 74.52 110.112 175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -97.78 126.81 43.33 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 120.978 0.418 . . . . 73.11 110.004 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.607 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -91.08 63.34 5.07 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 122.184 0.992 . . . . 71.31 112.064 -176.75 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.24 -37.67 86.31 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.93 -1.032 . . . . 65.12 111.772 -177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.78 -11.85 18.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.331 0.586 . . . . 63.31 111.14 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 42' ' ' LEU . 87.5 tttt -93.29 97.65 10.74 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 109.305 -0.628 . . . . 64.43 109.305 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -69.52 139.93 53.88 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 115.362 -0.835 . . . . 73.52 111.063 -175.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.566 ' HA ' ' NE1' ' A' ' 50' ' ' TRP . 17.4 p -121.28 28.55 7.74 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 113.174 0.805 . . . . 74.0 113.174 -170.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.7 m -57.92 97.12 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 122.094 0.95 . . . . 63.11 112.977 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.8 mttt 58.18 52.06 7.93 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.328 -1.76 . . . . 73.31 113.677 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.634 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 49.5 m0 -62.59 126.28 26.8 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 109.266 -0.642 . . . . 74.32 109.266 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -90.6 62.89 5.31 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.545 0.688 . . . . 61.43 109.526 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.8 m -83.64 -59.33 2.47 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.333 -0.849 . . . . 64.33 110.029 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.17 -27.4 66.38 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 115.293 -0.867 . . . . 53.35 109.897 -175.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 34.4 tt0 -68.68 -46.5 68.88 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.906 -0.588 . . . . 55.23 110.036 177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -62.32 -45.22 94.21 Favored 'General case' 0 CA--C 1.498 -1.032 0 C-N-CA 120.602 -0.439 . . . . 74.35 111.058 178.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.3 m -74.57 -26.56 20.1 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.509 0 C-N-CA 118.876 -1.13 . . . . 61.44 112.237 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.16 -20.74 62.26 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.706 0.765 . . . . 61.21 109.687 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 54' ' ' GLU . 34.8 mt-10 -91.83 -36.83 13.3 Favored 'General case' 0 N--CA 1.416 -2.129 0 C-N-CA 119.854 -0.738 . . . . 71.5 111.479 176.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.26 -32.76 22.4 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.991 1.108 . . . . 74.11 113.991 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.589 ' O ' HD23 ' A' ' 60' ' ' LEU . 6.7 tt -109.87 -3.9 16.33 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.107 -0.701 . . . . 75.45 109.107 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 81.82 -171.47 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.124 1.369 . . . . 70.32 111.584 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.471 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 6.4 pt-20 -53.48 -29.2 34.87 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 126.894 2.078 . . . . 63.2 116.271 -170.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' HD2' ' HG3' ' A' ' 62' ' ' GLU . 13.9 mptt -73.76 -7.89 53.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.205 0.817 . . . . 54.21 113.205 -177.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.2 11.88 30.83 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 112.314 0.487 . . . . 64.45 112.314 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.2 p -64.66 130.01 29.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-O 121.243 0.544 . . . . 33.51 110.102 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 62.06 47.91 86.79 Favored Glycine 0 C--N 1.308 -0.972 0 CA-C-N 115.264 -0.88 . . . . 72.23 111.372 -176.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 tp -60.17 -38.0 75.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 123.271 0.628 . . . . 75.2 112.527 -174.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.463 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.5 OUTLIER -72.58 -37.66 68.1 Favored 'General case' 0 C--O 1.203 -1.344 0 C-N-CA 120.296 -0.562 . . . . 75.04 110.306 -177.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -67.89 -37.69 82.08 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.533 -0.543 . . . . 74.02 109.533 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 74' ' ' ILE . 0.8 OUTLIER -64.93 -46.93 79.56 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.508 -0.769 . . . . 74.2 109.33 175.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -64.57 -35.28 80.48 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 116.17 -0.468 . . . . 73.2 111.734 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 98' ' ' ASN . 5.4 mp -60.9 -44.27 97.37 Favored 'General case' 0 CA--C 1.49 -1.338 0 O-C-N 123.385 0.428 . . . . 72.15 110.388 175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.49 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . . . -69.48 -40.03 77.31 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.333 -0.547 . . . . 72.05 110.937 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 70' ' ' ARG . 79.6 mt -64.26 -43.77 97.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.006 0.432 . . . . 64.41 110.069 179.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.84 -31.7 66.77 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 116.405 -0.361 . . . . 62.33 110.702 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 73' ' ' ALA . 26.2 ttpp -57.47 -45.06 85.25 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 123.351 0.661 . . . . 70.42 110.256 171.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -64.23 -46.86 81.99 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.074 -0.512 . . . . 71.33 110.541 175.7 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -68.53 -23.55 64.54 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 113.663 0.986 . . . . 73.14 113.663 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 -67.98 -50.28 56.65 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.349 -0.982 . . . . 65.13 108.349 174.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.414 ' O ' HG23 ' A' ' 84' ' ' VAL . 37.9 ttpt -58.93 -45.49 90.29 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.225 -0.898 . . . . 72.51 109.794 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 63.9 mt -68.13 -34.37 76.22 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.129 -0.942 . . . . 33.23 111.478 -177.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -66.88 -36.46 82.36 Favored 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 108.881 -0.785 . . . . 53.23 108.881 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 39.9 t -67.78 -21.25 65.26 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.627 0.727 . . . . 63.04 111.505 178.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 80' ' ' LYS . 65.2 t -82.16 -27.56 9.21 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 109.218 -0.66 . . . . 74.02 109.218 175.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 81' ' ' LEU . 70.2 mt -95.7 -18.16 20.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.797 0.665 . . . . 74.22 112.797 -175.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.1 m -121.65 146.49 46.95 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.946 -0.39 . . . . 61.12 109.946 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 t -92.14 140.92 29.15 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.211 -0.663 . . . . 71.42 109.211 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.64 12.19 64.89 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.549 -0.834 . . . . 64.5 112.525 177.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.455 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 34.7 t -110.69 153.62 12.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.301 -1.37 . . . . 72.02 107.301 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -111.89 153.87 26.04 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.321 -0.992 . . . . 70.2 108.321 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -82.86 13.87 3.63 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.641 0.258 . . . . 71.12 111.541 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -148.29 114.29 3.87 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 122.519 0.328 . . . . 62.15 111.32 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -85.98 168.15 9.37 Favored 'Trans proline' 0 C--O 1.25 1.091 0 C-N-CA 123.262 2.641 . . . . 72.44 112.509 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -99.63 -33.91 10.43 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.61 -0.885 . . . . 74.54 108.61 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.55 ' O ' ' HA ' ' A' ' 39' ' ' SER . 79.3 m-70 -103.41 106.3 16.79 Favored 'General case' 0 N--CA 1.422 -1.834 0 N-CA-C 107.216 -1.402 . . . . 74.13 107.216 177.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.0 m -103.83 132.61 49.88 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.574 0 CA-C-O 120.867 0.365 . . . . 70.24 111.175 174.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.1 141.76 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.521 -0.763 . . . . 44.05 110.056 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.468 ' HA ' HD21 ' A' ' 72' ' ' LEU . 50.0 t30 -113.91 -28.13 7.49 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.518 0.675 . . . . 63.1 111.418 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.634 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 16.7 mmm180 -133.28 137.7 46.13 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 121.7 -0.625 . . . . 72.0 111.5 -170.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 68.8 t -122.58 128.4 75.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 N-CA-C 106.837 -1.542 . . . . 73.23 106.837 176.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 94.7 p -94.01 164.5 20.31 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.394 -0.965 . . . . 35.31 108.394 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.499 ' O ' HG13 ' A' ' 106' ' ' ILE . 50.1 Cg_exo -53.11 -37.34 79.37 Favored 'Trans proline' 0 C--N 1.367 1.503 0 C-N-CA 122.171 1.914 . . . . 73.24 111.397 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.13 -44.23 97.5 Favored Glycine 0 C--N 1.318 -0.454 0 CA-C-N 115.31 -0.859 . . . . 40.25 112.157 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -70.77 -38.06 73.42 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.131 -0.692 . . . . 63.41 109.131 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -58.61 -43.05 89.49 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 114.654 -1.157 . . . . 71.1 111.289 -177.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 102' ' ' PRO . 73.8 mt -57.37 -37.92 59.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.824 0.345 . . . . 73.51 111.095 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.51 ' O ' HG23 ' A' ' 111' ' ' VAL . 24.3 m -73.92 -42.66 60.29 Favored 'General case' 0 N--CA 1.432 -1.327 0 C-N-CA 120.043 -0.663 . . . . 63.34 110.231 178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 89.9 mtp -66.62 -37.54 85.08 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.171 -0.468 . . . . 71.35 111.688 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.572 ' HG ' ' SD ' ' A' ' 192' ' ' MET . 8.5 mp -65.49 -37.78 87.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.897 0.38 . . . . 70.24 111.124 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -67.82 -35.73 79.12 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.407 -0.59 . . . . 74.24 109.407 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 107' ' ' SER . 98.6 t -64.31 -45.2 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 115.864 -0.607 . . . . 75.33 111.439 176.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.82 -30.73 71.79 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 112.509 0.559 . . . . 75.03 112.509 -178.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.53 ' HA ' ' ND2' ' A' ' 189' ' ' ASN . 44.2 t -73.23 -44.71 59.07 Favored 'General case' 0 N--CA 1.417 -2.098 0 C-N-CA 120.239 -0.585 . . . . 74.34 110.726 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 14.3 tt -74.83 -34.87 34.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 119.966 -0.694 . . . . 71.31 111.19 -177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 17.8 p -65.65 -36.18 82.95 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 112.367 0.506 . . . . 43.22 112.367 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -73.67 -26.3 60.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 117.946 -1.502 . . . . 74.24 109.184 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -70.73 -42.57 70.35 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.668 -0.696 . . . . 71.32 111.526 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.411 ' OE1' ' HB3' ' A' ' 27' ' ' LEU . 7.8 pt-20 -68.77 -40.75 79.57 Favored 'General case' 0 C--O 1.214 -0.772 0 C-N-CA 120.201 -0.599 . . . . 73.13 110.687 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 115' ' ' THR . 89.5 mt -65.46 -39.7 92.32 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 111.965 0.357 . . . . 73.43 111.965 -178.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 p -70.16 -31.59 69.15 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.924 0.392 . . . . 63.5 111.2 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 25.2 m -78.82 -33.41 46.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 116.186 -0.461 . . . . 35.51 110.019 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.12 -50.1 74.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 107.456 -1.313 . . . . 75.52 107.456 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 126' ' ' ILE . 57.4 tttm -56.76 -44.11 81.46 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.781 0.675 . . . . 55.34 111.291 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -67.51 -38.81 84.86 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.29 0.567 . . . . 74.21 110.754 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.504 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 43.1 tptt -77.83 -32.82 52.42 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 115.903 -0.59 . . . . 64.51 111.638 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.625 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.6 tt -74.81 -30.15 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 120.316 -0.554 . . . . 64.31 109.858 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.83 -33.4 74.71 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.902 -0.777 . . . . 73.34 108.902 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -49.6 72.28 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.513 -1.221 . . . . 73.01 109.083 178.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.625 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.436 1.1 p90 -77.5 -18.38 57.12 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 115.349 1.611 . . . . 72.54 115.349 175.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.96 -33.24 72.89 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 107.68 -1.229 . . . . 51.11 107.68 170.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -79.01 -27.49 43.28 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 114.751 -1.113 . . . . 72.03 110.479 177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' A' ' 129' ' ' TRP . 78.1 t -65.96 113.14 2.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.778 0.799 . . . . 71.3 110.501 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -100.67 -164.25 1.1 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.31 -1.313 . . . . 64.52 107.855 178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.23 87.13 0.59 Allowed 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 108.913 -0.773 . . . . 61.41 108.913 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.3 t -71.71 157.85 37.19 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.143 -0.935 . . . . 53.13 111.612 -176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -63.69 -14.27 50.61 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 124.864 1.266 . . . . 73.11 111.615 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.08 -18.61 64.01 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 124.509 1.124 . . . . 64.24 110.853 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 98.43 12.98 43.11 Favored Glycine 0 CA--C 1.494 -1.257 0 N-CA-C 109.751 -1.339 . . . . 61.2 109.751 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.4 m -72.85 129.18 37.57 Favored 'General case' 0 N--CA 1.42 -1.965 0 CA-C-N 114.021 -1.09 . . . . 52.21 108.27 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -83.03 165.8 19.31 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 107.306 -1.368 . . . . 71.31 107.306 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.512 HG23 ' HG2' ' A' ' 143' ' ' GLN . 17.0 m -67.73 134.04 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 109.389 -0.597 . . . . 72.11 109.389 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 169' ' ' LEU . 50.9 mm -79.29 96.78 2.35 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.924 0 N-CA-C 108.374 -0.973 . . . . 74.41 108.374 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HA ' HD12 ' A' ' 169' ' ' LEU . 29.2 mm-40 -103.64 -30.97 10.13 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 114.829 -1.078 . . . . 65.3 112.594 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -120.1 156.53 30.83 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.312 0.577 . . . . 74.24 109.464 -175.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.527 ' O ' ' HB ' ' A' ' 150' ' ' THR . 42.9 mm -70.78 -21.29 22.53 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.288 0 CA-C-O 121.587 0.708 . . . . 75.33 109.327 175.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -88.65 18.41 4.68 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-O 122.05 0.928 . . . . 74.03 110.389 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -87.46 155.21 20.11 Favored 'General case' 0 CA--C 1.483 -1.62 0 N-CA-C 108.919 -0.771 . . . . 62.15 108.919 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -48.66 -42.4 34.42 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.949 1.3 . . . . 61.44 113.592 -169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -77.68 -42.22 35.33 Favored 'General case' 0 C--N 1.298 -1.646 0 C-N-CA 120.778 -0.369 . . . . 75.2 111.601 -177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.527 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -70.74 -42.01 71.06 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.699 -0.682 . . . . 74.42 110.01 -176.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 155' ' ' VAL . 60.0 t30 -63.4 -36.16 82.8 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 114.231 -1.349 . . . . 72.24 109.215 -178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 99.2 m -60.14 -43.86 95.4 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.509 -0.314 . . . . 73.22 111.375 178.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.492 ' HB2' ' HH2' ' A' ' 129' ' ' TRP . 54.5 t90 -72.22 -40.5 67.73 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.009 -0.677 . . . . 62.43 109.727 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -66.53 -45.84 78.15 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 115.49 -0.777 . . . . 64.04 112.377 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 151' ' ' ASN . 24.7 m -64.97 -35.13 74.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 121.708 -0.62 . . . . 72.15 112.239 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.76 -37.78 88.66 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.894 0.378 . . . . 73.44 111.106 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -81.97 -9.86 59.44 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 114.626 1.343 . . . . 73.12 114.626 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.45 -0.05 18.45 Favored Glycine 0 CA--C 1.5 -0.872 0 C-N-CA 118.903 -1.618 . . . . 41.51 113.765 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -82.17 110.73 17.64 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 108.955 -0.757 . . . . 71.25 108.955 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 14.8 mmtm -76.83 137.08 38.99 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 116.214 -0.448 . . . . 74.1 110.932 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.53 -35.07 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.955 0.902 . . . . 74.21 112.089 -176.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.5 2.01 55.14 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 111.994 0.368 . . . . 55.14 111.994 -177.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -122.66 -29.58 4.01 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 112.868 0.692 . . . . 64.04 112.868 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -76.28 164.09 26.39 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 118.899 -1.121 . . . . 63.11 109.375 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -98.93 118.01 34.73 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 108.033 -1.099 . . . . 45.2 108.033 -177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.76 111.01 15.65 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.239 1.018 . . . . 74.03 108.645 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.491 ' O ' HG12 ' A' ' 145' ' ' ILE . 14.1 t -123.76 161.76 25.7 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 107.54 -1.282 . . . . 64.2 107.54 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 41.8 p -68.41 147.48 52.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.904 -0.406 . . . . 55.34 109.904 175.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -59.4 -29.25 67.6 Favored 'General case' 0 C--O 1.207 -1.159 0 CA-C-N 115.489 -0.778 . . . . 55.14 110.421 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . 0.456 ' H ' HD13 ' A' ' 169' ' ' LEU . 43.7 tt0 -73.28 -42.08 62.86 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.492 -0.776 . . . . 74.2 110.031 -177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.461 ' HB2' HG12 ' A' ' 167' ' ' VAL . 33.2 mmtp -71.57 -40.54 69.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 119.85 -0.74 . . . . 62.24 109.29 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.82 -38.7 86.96 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.111 -0.7 . . . . 63.14 109.111 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.59 98.3 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.741 -0.209 . . . . 62.14 111.147 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 15.3 t -72.87 -33.01 65.81 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 119.647 -0.821 . . . . 71.11 110.544 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.449 ' O ' HD13 ' A' ' 179' ' ' LEU . 79.7 t -65.07 -52.12 57.52 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 CA-C-N 116.353 -0.385 . . . . 63.02 110.144 175.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 11.3 p -68.06 -30.4 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.431 -0.507 . . . . 64.44 110.365 -176.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -65.03 -38.96 92.57 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-N 116.001 -0.545 . . . . 73.02 109.55 175.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -66.54 -40.33 89.03 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 109.761 -0.459 . . . . 64.2 109.761 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.449 HD13 ' O ' ' A' ' 175' ' ' VAL . 10.9 mp -62.2 -45.3 93.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.903 -0.59 . . . . 74.31 112.518 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.69 -29.6 8.7 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 C-N-CA 120.434 -0.507 . . . . 40.14 111.875 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.417 ' HA ' HD11 ' A' ' 186' ' ' ILE . 36.2 m -96.45 15.17 22.14 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 121.142 0.496 . . . . 60.21 111.136 -177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.53 ' O ' HG13 ' A' ' 186' ' ' ILE . 51.3 t-80 -71.78 111.07 6.75 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 106.063 -1.828 . . . . 75.44 106.063 173.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.23 -36.86 83.28 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 114.654 1.353 . . . . 64.55 114.654 -170.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.06 -35.43 71.92 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.605 -0.838 . . . . 75.33 108.961 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . 0.567 ' HA ' HG22 ' A' ' 188' ' ' ILE . 16.6 tpt -66.61 -39.25 88.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.926 -1.034 . . . . 72.22 111.058 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 182' ' ' HIS . 56.9 mt -65.47 -43.8 94.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.792 -0.447 . . . . 51.14 109.792 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -67.86 -41.31 83.07 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 115.65 -0.704 . . . . 74.51 110.596 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 185' ' ' MET . 11.2 tp -70.5 -32.09 48.72 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.828 0 C-N-CA 119.753 -0.779 . . . . 62.41 109.664 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . 0.53 ' ND2' ' HA ' ' A' ' 113' ' ' SER . 28.1 t-20 -69.27 -39.93 78.1 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.425 0.155 . . . . 72.03 111.155 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.84 -43.77 87.5 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.211 0.529 . . . . 72.03 109.697 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -69.61 -27.61 65.23 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.369 -0.832 . . . . 65.42 110.254 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.572 ' SD ' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -68.74 -46.89 67.68 Favored 'General case' 0 C--O 1.205 -1.238 0 N-CA-C 108.161 -1.052 . . . . 53.04 108.161 178.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -57.85 -42.61 84.82 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.563 -0.903 . . . . 64.32 108.563 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -67.9 -38.63 83.19 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.73 -0.668 . . . . 74.31 111.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -71.53 -40.97 69.72 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 116.275 -0.421 . . . . 74.33 110.791 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 23.5 m -73.41 -31.01 31.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 120.867 -0.333 . . . . 64.24 110.681 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.16 -26.3 61.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 C-N-CA 120.298 -0.561 . . . . 53.15 111.354 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -75.24 -44.7 44.65 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 108.577 -0.897 . . . . 74.44 108.577 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 43.1 m0 -65.6 -37.63 87.15 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.788 0.662 . . . . 60.2 112.788 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 17.2 p -68.87 -38.31 79.62 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.546 -0.462 . . . . 62.11 110.454 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -61.77 -49.91 74.5 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.6 -0.727 . . . . 75.22 109.374 174.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.29 -42.53 95.69 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 123.871 0.732 . . . . 53.41 110.905 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -65.68 -43.86 88.0 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.947 -0.39 . . . . 74.24 109.947 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 48.7 m -68.39 -41.33 80.65 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.282 0.563 . . . . 74.25 110.77 -178.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -73.1 -34.07 65.96 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 115.107 -0.951 . . . . 71.31 110.005 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . 0.569 ' O ' ' HG3' ' A' ' 210' ' ' MET . 98.3 mtt180 -78.26 -32.69 49.74 Favored 'General case' 0 C--O 1.205 -1.264 0 C-N-CA 120.446 -0.502 . . . . 64.23 110.8 176.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.4 tp -65.01 -38.0 89.49 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.105 -0.702 . . . . 74.54 109.105 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.36 82.66 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.859 -0.61 . . . . 73.44 109.507 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.2 ttt -68.07 -35.02 77.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.65 -0.705 . . . . 75.45 110.228 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 206' ' ' ARG . 65.6 mtt -68.05 -38.17 82.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.056 -0.52 . . . . 64.11 109.753 176.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.86 75.86 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.75 -0.659 . . . . 64.32 110.223 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -59.14 -44.21 92.05 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.084 0.954 . . . . 61.13 108.708 174.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.36 -45.68 90.07 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.347 -0.842 . . . . 64.35 109.338 176.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 135.62 -71.5 0.48 Allowed Glycine 0 N--CA 1.433 -1.561 0 N-CA-C 108.694 -1.762 . . . . 70.41 108.694 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 13.2 tt -144.14 140.3 24.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.555 -0.905 . . . . 63.1 108.555 175.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 26.5 t -131.98 -41.2 1.03 Allowed 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.132 -0.692 . . . . 63.22 109.132 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 146.32 -85.68 0.17 Allowed Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 109.786 -1.326 . . . . 73.34 109.786 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . 0.466 ' HB2' ' SD ' ' A' ' 210' ' ' MET . . . 54.66 78.54 0.17 Allowed 'General case' 0 C--O 1.243 0.745 0 C-N-CA 124.717 1.207 . . . . 73.4 113.059 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -141.89 147.67 37.48 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.385 -0.968 . . . . 62.11 108.385 178.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 146.61 123.42 1.48 Allowed Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.099 -0.8 . . . . 42.25 111.099 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -127.53 140.8 51.89 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 122.714 0.406 . . . . 72.41 110.012 -177.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -93.07 114.57 27.15 Favored 'General case' 0 C--N 1.298 -1.661 0 N-CA-C 109.07 -0.715 . . . . 71.24 109.07 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 CA--C 1.483 -1.626 0 N-CA-C 107.503 -1.295 . . . . 70.22 107.503 174.381 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.436 -1.126 0 CA-C-O 121.157 0.504 . . . . 71.33 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.2 p -154.89 149.87 26.83 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.591 -1.263 . . . . 64.3 107.591 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.67 171.76 20.69 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.814 -1.184 . . . . 61.42 112.834 -176.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 64.0 mt -129.33 91.92 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.253 1.246 0 N-CA-C 108.714 -0.847 . . . . 74.33 108.714 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.42 132.07 35.83 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.655 -1.609 . . . . 74.04 106.655 -178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -136.68 26.48 3.03 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.381 -0.914 . . . . 62.01 113.379 -175.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 50.4 t -70.91 95.49 1.17 Allowed 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.274 0.559 . . . . 73.44 110.186 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -78.61 115.3 18.22 Favored 'General case' 0 N--CA 1.426 -1.638 0 N-CA-C 106.658 -1.608 . . . . 64.43 106.658 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.25 108.42 5.77 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.806 0.669 . . . . 51.3 112.806 -172.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -122.35 105.85 10.56 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.448 -1.686 . . . . 73.51 106.448 171.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -84.03 -17.32 40.78 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 116.036 -0.529 . . . . 73.33 112.032 -173.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? 71.54 144.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.076 1.35 . . . . 74.23 111.487 -177.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -113.18 88.43 2.83 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 107.775 -1.195 . . . . 73.32 107.775 170.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -73.23 -7.14 50.19 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 114.473 -1.239 . . . . 75.11 113.12 -173.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.7 t 66.42 79.35 0.24 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 122.388 1.09 . . . . 74.25 109.355 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 26.4 t -101.6 115.82 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.631 0 CA-C-N 114.483 -1.235 . . . . 63.55 107.738 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.61 83.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.05 0 CA-C-O 122.562 1.172 . . . . 63.02 109.341 177.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -108.51 95.0 5.36 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.774 -1.103 . . . . 74.4 109.104 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.79 51.43 0.19 Allowed Glycine 0 N--CA 1.419 -2.446 0 N-CA-C 110.744 -0.943 . . . . 74.14 110.744 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.8 78.93 9.63 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.452 -0.944 . . . . 73.45 108.452 177.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.5 t -98.85 174.62 6.29 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-N 114.218 -1.355 . . . . 74.42 109.101 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.6 m -72.91 95.12 1.92 Allowed 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.97 -0.559 . . . . 64.24 109.624 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -75.32 101.12 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 121.597 0.713 . . . . 73.24 111.325 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 65.74 91.25 0.08 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 113.754 -1.566 . . . . 71.13 109.832 -178.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -84.11 176.04 9.08 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.614 -1.176 . . . . 73.51 111.053 -176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 26.8 m -76.35 177.48 7.28 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 115.748 -0.66 . . . . 72.02 110.427 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.15 -23.6 63.97 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 120.874 0.368 . . . . 53.3 111.452 -173.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -74.02 -49.95 21.98 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 116.263 -0.426 . . . . 72.41 110.558 178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -64.72 -27.17 68.72 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.144 0.497 . . . . 74.11 110.279 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.07 -48.66 72.97 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 108.249 -1.019 . . . . 74.21 108.249 177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 82' ' ' LYS . 61.7 mt -60.3 -41.35 86.77 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-N 114.979 -1.01 . . . . 64.43 110.459 176.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.09 -40.69 90.49 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.984 -0.553 . . . . 72.11 111.192 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -69.67 -40.16 76.58 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 109.404 -0.591 . . . . 72.41 109.404 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.61 -48.12 82.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.739 -0.664 . . . . 65.13 109.326 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.52 -38.33 80.8 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.817 -0.628 . . . . 63.43 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 36.0 mt-10 -75.3 -21.23 58.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 N-CA-C 112.539 0.57 . . . . 70.23 112.539 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -73.55 -40.56 63.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 120.844 -0.343 . . . . 71.5 110.228 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 82.5 t80 -78.61 -13.75 59.67 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 119.448 -0.901 . . . . 73.43 110.508 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 t -109.09 28.55 8.38 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.405 -0.816 . . . . 74.23 109.466 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLU . . . -112.05 136.22 51.69 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 176.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.6 163.36 12.69 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.909 -1.145 . . . . 73.44 107.909 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.48 HD21 ' O ' ' A' ' 99' ' ' ARG 0.317 0.9 OUTLIER -143.58 60.21 1.39 Allowed 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 122.733 1.254 . . . . 72.13 111.848 172.951 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 m -74.37 -22.88 59.0 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.439 -1.255 . . . . 70.11 111.258 -176.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -82.55 -9.13 59.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 121.457 0.646 . . . . 74.14 109.357 178.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -88.8 118.18 28.31 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.307 -0.861 . . . . 64.45 109.539 177.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -92.57 107.1 18.96 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 107.528 -1.286 . . . . 73.52 107.528 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.676 HG21 ' HG3' ' A' ' 99' ' ' ARG . 25.1 p -93.24 85.49 5.04 Favored 'General case' 0 N--CA 1.409 -2.517 0 CA-C-O 122.393 1.092 . . . . 62.12 110.514 -174.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.4 p -106.85 96.05 6.16 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.135 -1.393 . . . . 72.13 110.109 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 69.79 62.03 0.26 Allowed 'General case' 0 C--O 1.247 0.969 0 CA-C-N 114.245 -1.343 . . . . 72.02 111.474 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.684 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 6.1 m0 -77.62 108.18 10.62 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.131 -0.941 . . . . 72.4 110.019 173.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.473 ' HB3' ' CB ' ' A' ' 54' ' ' GLU . 14.0 m120 -97.8 63.41 1.68 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 122.622 1.201 . . . . 72.1 109.663 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.59 -35.56 34.01 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.068 -1.827 . . . . 53.43 106.068 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -63.04 -31.17 72.25 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 113.412 -1.722 . . . . 44.2 110.261 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.473 ' CB ' ' HB3' ' A' ' 51' ' ' ASN . 3.9 tp10 -71.11 -39.92 71.77 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 114.963 -1.017 . . . . 71.13 109.479 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.8 tptt -65.51 -44.79 85.86 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.218 -0.901 . . . . 75.41 109.841 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 67' ' ' ILE . 19.6 m -74.94 -19.03 16.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 112.397 0.517 . . . . 63.45 112.397 -178.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 57' ' ' LYS . 31.2 ttpt -66.75 -37.59 84.94 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.039 -1.097 . . . . 64.31 108.039 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.7 -33.29 53.2 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.079 -0.51 . . . . 73.22 110.347 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 55' ' ' LYS . 89.1 mt -74.35 -47.5 33.92 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-N 115.838 -0.619 . . . . 73.52 112.539 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -138.51 13.05 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 114.563 1.32 . . . . 52.51 114.563 -170.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 71.39 -173.56 0.17 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 113.208 0.818 . . . . 71.3 113.208 174.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -54.08 -17.93 3.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 125.752 1.621 . . . . 73.14 114.738 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -83.44 -16.96 43.77 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 112.533 0.568 . . . . 72.42 112.533 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.85 12.71 12.16 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-O 120.915 0.388 . . . . 74.23 110.962 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 p -69.62 147.56 11.81 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 121.43 0.633 . . . . 74.41 110.275 -177.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.97 57.21 3.54 Favored Glycine 0 C--N 1.304 -1.244 0 N-CA-C 110.02 -1.232 . . . . 34.31 110.02 -177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.495 ' HB ' HG21 ' A' ' 56' ' ' VAL . 9.7 tp -72.8 -33.99 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 N-CA-C 113.175 0.806 . . . . 74.3 113.175 -171.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.1 -44.67 88.08 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.138 -0.625 . . . . 63.01 110.607 -177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.0 m -68.82 -32.8 72.76 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.356 0.598 . . . . 72.21 109.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -67.09 -45.97 75.65 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.022 -0.99 . . . . 71.24 108.496 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.73 -38.82 91.98 Favored 'General case' 0 C--O 1.192 -1.955 0 CA-C-N 115.395 -0.82 . . . . 72.42 110.676 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 97' ' ' ALA . 9.7 mp -61.13 -46.33 91.02 Favored 'General case' 0 CA--C 1.5 -0.953 0 C-N-CA 120.562 -0.455 . . . . 72.22 111.589 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.64 -38.53 80.54 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 120.276 -0.57 . . . . 72.24 111.366 -177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.4 mt -75.29 -37.58 39.25 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 C-N-CA 120.45 -0.5 . . . . 73.12 110.694 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 38' ' ' TYR . . . -69.8 -37.78 76.4 Favored 'General case' 0 C--O 1.191 -2.002 0 CA-C-O 119.02 -0.514 . . . . 74.41 111.57 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.619 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 20.3 pttp -64.48 -37.89 89.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 120.405 -0.518 . . . . 53.21 111.32 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.504 ' OE1' ' HG3' ' A' ' 76' ' ' LYS . 0.4 OUTLIER -66.93 -43.31 83.55 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.68 -0.236 . . . . 63.55 110.513 175.383 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.35 -26.89 64.91 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 121.15 -0.22 . . . . 62.21 111.555 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -65.77 -51.23 60.83 Favored 'General case' 0 C--O 1.2 -1.5 0 N-CA-C 107.46 -1.311 . . . . 72.31 107.46 173.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.3 mmtt -59.69 -26.48 65.62 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 112.593 0.59 . . . . 73.0 112.593 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD13 HG23 ' A' ' 176' ' ' VAL . 88.8 mt -82.87 -51.57 7.51 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.129 0.49 . . . . 74.31 111.618 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HB3' HG23 ' A' ' 31' ' ' ILE . 5.3 mptp? -84.3 -36.4 22.64 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 115.719 1.748 . . . . 74.31 115.719 -173.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 86.6 p -65.9 -37.26 85.64 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 118.878 0.763 . . . . 73.34 110.882 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 97.6 t -64.3 -21.21 28.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.719 -0.673 . . . . 63.12 110.744 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 85.8 mt -77.75 -14.15 59.68 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.993 0.425 . . . . 64.23 110.672 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 66.5 m -113.13 124.25 52.13 Favored 'General case' 0 N--CA 1.421 -1.885 0 N-CA-C 109.303 -0.628 . . . . 72.22 109.303 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.488 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 15.4 t -76.44 134.0 39.69 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.492 0.663 . . . . 75.22 110.419 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.19 77.15 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 115.365 -0.834 . . . . 52.15 112.264 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 60.9 t -96.51 133.43 37.9 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.322 -0.622 . . . . 73.41 109.322 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -67.9 134.81 51.46 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 115.179 -0.919 . . . . 71.21 111.626 -177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -92.59 -2.51 56.09 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.973 0.892 . . . . 65.44 110.121 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 94.5 m -137.53 100.36 9.27 Favored Pre-proline 0 C--N 1.291 -1.966 0 CA-C-N 115.257 -0.883 . . . . 72.14 110.1 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -87.02 149.79 8.22 Favored 'Trans proline' 0 C--O 1.254 1.311 0 C-N-CA 122.411 2.074 . . . . 43.14 112.487 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.44 -30.87 11.19 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.761 0.791 . . . . 72.03 108.979 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 67.4 m80 -85.25 92.23 8.37 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 107.352 -1.351 . . . . 73.14 107.352 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.9 t -114.64 125.6 71.99 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.339 0 CA-C-N 116.071 -0.513 . . . . 53.53 109.681 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.529 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -78.0 116.53 18.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.227 -1.027 . . . . 71.44 108.227 177.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.416 ' N ' HD22 ' A' ' 98' ' ' ASN . 0.8 OUTLIER -80.93 -10.38 59.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.238 0.542 . . . . 60.0 111.26 -177.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.684 ' HB3' ' CE3' ' A' ' 50' ' ' TRP . 41.1 mmt180 -135.72 146.48 47.75 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 107.75 -1.204 . . . . 73.2 107.75 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.25 118.79 56.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 107.833 -1.173 . . . . 72.41 107.833 178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.3 p -54.26 134.4 60.63 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 123.947 0.899 . . . . 61.23 111.605 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -44.13 -48.03 9.91 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 124.343 3.362 . . . . 73.32 115.24 -175.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -66.42 -41.49 94.35 Favored Glycine 0 C--N 1.305 -1.183 0 N-CA-C 111.216 -0.754 . . . . 53.34 111.216 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -73.3 -24.77 60.45 Favored 'General case' 0 C--O 1.202 -1.423 0 CA-C-N 115.355 -0.422 . . . . 74.13 111.259 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -65.68 -40.38 92.32 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.773 -0.455 . . . . 71.31 109.773 176.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 68.4 mt -63.93 -44.67 98.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.724 -0.843 . . . . 74.24 108.724 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.1 m -61.3 -44.07 97.82 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.677 -0.692 . . . . 73.1 109.555 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.6 tpt -59.6 -40.79 88.65 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.472 1.109 . . . . 61.21 110.518 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 83.1 mt -64.14 -42.05 96.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.756 0.312 . . . . 62.25 110.162 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -67.67 -41.26 84.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.137 -0.483 . . . . 73.21 111.951 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 107' ' ' SER . 89.7 t -66.1 -41.52 89.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 110.034 -0.358 . . . . 73.22 110.034 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.22 -40.62 90.43 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.971 -0.752 . . . . 61.45 108.971 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.693 ' O ' ' HG3' ' A' ' 117' ' ' ARG . 22.9 t -65.26 -44.43 88.14 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 116.096 -0.502 . . . . 55.3 110.353 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.424 HG22 ' HA ' ' A' ' 111' ' ' VAL . 15.1 tt -74.87 -30.02 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 120.613 -0.435 . . . . 73.22 111.574 -176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 21.5 p -72.61 -21.82 61.06 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.992 0.901 . . . . 53.41 110.193 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -82.76 -22.42 34.32 Favored 'General case' 0 N--CA 1.427 -1.582 0 N-CA-C 109.171 -0.677 . . . . 71.03 109.171 174.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.693 ' HG3' ' O ' ' A' ' 113' ' ' SER . 60.5 mtt180 -78.03 -39.26 42.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.129 -0.487 . . . . 73.43 110.516 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.25 -30.3 67.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 119.213 -0.995 . . . . 72.24 110.248 173.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.517 HD21 HG21 ' A' ' 176' ' ' VAL . 3.1 tm? -66.55 -45.33 79.74 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 109.084 -0.71 . . . . 72.25 109.084 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 8.6 p -67.45 -31.99 72.53 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 121.079 -0.248 . . . . 74.5 111.576 178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -69.98 -41.42 74.47 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.146 -0.687 . . . . 74.42 109.146 175.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.453 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 4.7 tt -60.97 -47.11 87.96 Favored 'General case' 0 C--O 1.196 -1.712 0 CA-C-N 114.844 -1.071 . . . . 73.02 109.838 175.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -43.95 97.5 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 109.509 -0.552 . . . . 71.44 109.509 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -65.1 -39.59 93.36 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.766 -0.652 . . . . 74.51 112.003 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE3' ' CZ3' ' A' ' 129' ' ' TRP . 28.3 mtpp -84.48 -27.94 27.12 Favored 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 119.352 -0.939 . . . . 64.22 111.641 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.436 ' HA ' ' CD1' ' A' ' 129' ' ' TRP . 12.4 mt -63.41 -45.17 98.72 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.482 0 N-CA-C 110.044 -0.354 . . . . 64.45 110.044 174.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.66 -34.37 76.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.284 0.564 . . . . 62.31 109.84 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 125' ' ' LYS . 42.3 tt0 -65.48 -50.75 64.14 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 114.653 -1.158 . . . . 65.53 111.089 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.664 ' O ' HG12 ' A' ' 132' ' ' VAL 0.418 1.0 OUTLIER -81.29 -18.47 45.76 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 114.353 1.242 . . . . 74.42 114.353 178.417 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 130' ' ' LYS . 33.9 ttpt -67.74 -29.17 68.32 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.694 -1.224 . . . . 72.51 107.694 171.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -82.22 -18.86 41.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 114.539 -1.209 . . . . 71.2 110.493 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 129' ' ' TRP . 2.8 p -76.23 153.39 5.94 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 107.141 -1.429 . . . . 61.54 107.141 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -136.3 178.74 6.83 Favored 'General case' 0 C--N 1.278 -2.539 0 CA-C-N 116.467 -0.333 . . . . 73.0 110.527 -170.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.65 102.22 0.42 Allowed 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 124.674 1.234 . . . . 75.21 108.66 176.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 17.8 m -88.49 160.51 17.47 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.61 -1.177 . . . . 75.11 109.182 -176.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -56.76 -24.31 49.13 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.455 0.909 . . . . 73.43 113.455 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -64.0 -31.21 72.32 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.503 -0.772 . . . . 75.22 110.387 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 106.88 16.06 14.87 Favored Glycine 0 C--N 1.294 -1.781 0 N-CA-C 109.836 -1.305 . . . . 61.2 109.836 -172.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.575 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.5 m -73.15 116.93 14.28 Favored 'General case' 0 N--CA 1.428 -1.552 0 N-CA-C 107.203 -1.406 . . . . 72.12 107.203 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -72.83 -179.49 3.17 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 124.087 0.867 . . . . 61.54 112.209 -173.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.3 m -89.42 141.31 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.281 -1.007 . . . . 41.12 108.281 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.502 HD13 ' HB2' ' A' ' 149' ' ' ARG . 78.8 mt -98.54 95.9 4.7 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.065 0 CA-C-O 121.779 0.8 . . . . 64.01 110.3 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -117.29 -10.0 10.85 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.164 -0.925 . . . . 64.41 113.103 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.46 ' HB3' ' OD1' ' A' ' 166' ' ' ASP . 2.6 m120 -120.65 163.06 18.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.203 0.525 . . . . 75.25 111.489 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 150' ' ' THR . 45.0 mt -67.97 -35.0 70.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.826 -0.805 . . . . 75.34 108.826 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -81.75 27.49 0.45 Allowed 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 115.027 -0.988 . . . . 72.02 112.242 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.4 ' HB2' HG23 ' A' ' 142' ' ' ILE . 52.0 m-20 -95.54 153.5 17.68 Favored 'General case' 0 N--CA 1.415 -2.224 0 N-CA-C 105.706 -1.961 . . . . 74.22 105.706 174.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.63 -37.53 81.76 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 114.576 1.324 . . . . 63.33 114.576 -165.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HB2' HD13 ' A' ' 142' ' ' ILE . 39.2 mmt180 -76.33 -36.2 58.37 Favored 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.87 -0.732 . . . . 73.13 110.84 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.7 -44.36 74.1 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.848 -0.797 . . . . 64.41 108.848 178.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -57.38 -42.3 81.9 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.998 1.319 . . . . 70.1 109.282 177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 87.5 m -63.99 -38.12 89.9 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.874 -0.603 . . . . 72.41 111.204 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 122' ' ' LEU . 85.4 t90 -66.18 -45.43 80.9 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.773 -0.454 . . . . 74.11 109.773 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.495 ' HD1' ' O ' ' A' ' 150' ' ' THR . 38.2 m-85 -63.5 -47.46 81.64 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.645 -0.707 . . . . 72.45 111.48 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 30.6 m -64.44 -33.11 60.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 112.748 0.648 . . . . 72.14 112.748 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.34 -37.57 80.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.936 0.398 . . . . 72.02 111.205 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -77.78 -4.39 46.16 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 114.16 1.17 . . . . 65.32 114.16 -178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.46 -10.09 16.93 Favored Glycine 0 CA--C 1.497 -1.086 0 C-N-CA 119.488 -1.339 . . . . 51.4 112.652 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.406 ' HD1' ' O ' ' A' ' 154' ' ' PHE . 52.6 m-85 -72.32 111.56 7.63 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 121.215 0.531 . . . . 62.21 110.37 -177.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -67.45 143.58 56.16 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.413 -1.329 . . . . 70.41 107.413 172.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 99.3 t -60.02 -33.37 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.898 0.38 . . . . 72.52 111.689 -176.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.81 -1.95 55.37 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.181 0.515 . . . . 20.23 111.461 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 86' ' ' CYS . 49.5 mm-40 -100.0 -39.14 8.28 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 116.318 -0.401 . . . . 75.32 109.933 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.7 pp -73.64 134.0 43.56 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 122.067 0.936 . . . . 74.24 112.512 -175.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.488 ' HB2' ' N ' ' A' ' 87' ' ' THR . 64.5 t30 -109.77 140.12 44.05 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.277 -1.379 . . . . 73.13 107.277 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.46 ' OD1' ' HB3' ' A' ' 144' ' ' ASN . 27.1 t70 -92.08 142.71 27.21 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 120.932 0.396 . . . . 72.14 111.858 -175.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.7 p -154.75 159.72 2.94 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 104.696 -2.335 . . . . 64.14 104.696 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 17.6 p -71.94 143.55 49.24 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 119.578 -0.849 . . . . 60.54 110.728 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.419 ' HB3' HG23 ' A' ' 126' ' ' ILE . 71.7 mt -71.42 -33.33 69.33 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.114 -0.948 . . . . 75.43 109.385 -176.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -68.44 -36.96 79.79 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.137 -0.938 . . . . 73.41 110.662 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.2 -41.75 57.15 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.866 -0.79 . . . . 75.4 108.866 179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 62.0 tp -63.1 -45.88 90.0 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.683 -0.689 . . . . 62.3 110.909 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.36 -36.71 81.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 120.96 -0.296 . . . . 71.31 111.523 -176.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 p -75.45 -34.15 60.94 Favored 'General case' 0 N--CA 1.432 -1.372 0 C-N-CA 119.775 -0.77 . . . . 64.01 112.097 -179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.3 p -76.61 -39.82 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 C-N-CA 119.107 -1.037 . . . . 73.25 110.423 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.545 HG23 HD13 ' A' ' 81' ' ' LEU . 9.2 p -74.01 -31.92 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 C-N-CA 119.003 -1.079 . . . . 52.51 111.225 -176.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.83 -30.11 70.21 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.721 -0.844 . . . . 73.31 108.721 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.44 -46.71 59.35 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 116.049 -0.523 . . . . 71.15 109.979 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.39 -34.37 78.16 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.2 0.815 . . . . 61.33 113.2 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 24.9 m -79.66 -17.99 12.78 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.286 -0.566 . . . . 72.34 111.183 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 43.2 t -94.12 3.23 55.58 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 113.195 0.813 . . . . 75.4 113.195 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -72.71 146.83 46.2 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 117.395 -1.722 . . . . 75.21 109.413 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.58 -42.47 67.63 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.853 1.427 . . . . 53.44 114.853 -171.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -71.91 -34.85 69.43 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.402 0.62 . . . . 72.12 110.208 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.42 -45.21 69.7 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.381 -0.827 . . . . 64.31 111.186 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.1 tt -68.67 -28.23 39.22 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 C-N-CA 120.581 -0.447 . . . . 53.01 111.788 -174.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -75.65 -50.41 15.51 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 118.498 -1.281 . . . . 74.44 110.242 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 40.9 mm -62.73 -40.4 88.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 CA-C-O 121.024 0.44 . . . . 75.14 111.0 -174.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -68.76 -37.89 79.7 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 116.339 -0.391 . . . . 71.04 111.503 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -76.85 -35.92 57.17 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 120.011 -0.675 . . . . 74.52 110.245 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.36 -42.71 87.62 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.747 -0.66 . . . . 71.44 109.817 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -68.11 -34.16 75.86 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-N 116.545 -0.298 . . . . 45.21 111.216 177.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -63.58 -40.28 96.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.0 -0.741 . . . . 65.2 109.0 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.59 -36.54 70.88 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.082 -0.508 . . . . 72.42 110.819 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -66.61 -42.68 86.49 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.264 -0.425 . . . . 72.01 110.502 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 30.2 m -70.93 -29.99 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 C-N-CA 120.529 -0.468 . . . . 60.31 110.621 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -71.04 -40.98 71.4 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.71 -0.478 . . . . 43.12 109.71 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -58.54 -46.53 86.65 Favored 'General case' 0 C--O 1.213 -0.825 0 N-CA-C 108.687 -0.857 . . . . 75.21 108.687 175.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -63.5 -30.92 71.97 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-N 115.902 -0.59 . . . . 73.35 112.275 176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 31.7 m -64.14 -43.77 94.22 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.251 -1.018 . . . . 75.35 108.251 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 6.8 tmtm? -69.31 -40.18 77.81 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.583 -0.735 . . . . 74.1 110.247 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -69.29 -39.94 78.02 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.968 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -76.15 -34.02 59.4 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.638 -0.425 . . . . 74.41 111.447 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 23.8 p -72.9 -32.34 65.29 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 119.815 -0.754 . . . . 73.15 110.153 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -70.16 -39.07 75.55 Favored 'General case' 0 N--CA 1.437 -1.102 0 N-CA-C 108.605 -0.887 . . . . 54.2 108.605 175.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -64.24 -42.61 96.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.5 -0.773 . . . . 64.04 109.351 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.51 -42.89 91.54 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 108.886 -0.783 . . . . 74.25 108.886 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -66.85 -38.5 86.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.022 0.439 . . . . 53.55 110.68 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 25.5 ttt -62.41 -45.28 93.83 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.627 -0.715 . . . . 74.54 109.774 177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 66.1 mtt -67.12 -39.35 86.62 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.569 -0.742 . . . . 75.44 110.74 178.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -70.7 -27.77 64.24 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.64 0.607 . . . . 54.52 112.64 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -36.83 66.39 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.033 -1.099 . . . . 75.55 108.033 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -53.92 7.2 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.298 -1.001 . . . . 73.4 108.298 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -148.93 -95.45 0.15 Allowed Glycine 0 C--N 1.305 -1.148 0 N-CA-C 110.562 -1.015 . . . . 73.4 110.562 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 38.3 pt -144.05 166.76 12.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 108.469 -0.937 . . . . 72.31 108.469 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 12.4 t -100.75 88.6 3.63 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 106.798 -1.556 . . . . 72.21 106.798 174.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -103.41 129.02 9.72 Favored Glycine 0 N--CA 1.432 -1.58 0 C-N-CA 120.495 -0.859 . . . . 61.52 112.295 -176.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -116.91 -178.28 3.4 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.457 -0.571 . . . . 54.42 109.457 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -91.42 -50.74 5.64 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 110.161 -0.311 . . . . 60.44 110.161 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . 72.08 35.58 60.95 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.98 -0.554 . . . . 70.33 112.677 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -80.44 -51.93 8.25 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.79 -0.241 . . . . 71.12 110.421 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . 0.407 ' HD3' ' HB2' ' A' ' 223' ' ' ASP . 13.1 tmtt? 77.63 136.63 0.06 Allowed 'General case' 0 C--O 1.246 0.904 0 O-C-N 124.938 1.399 . . . . 72.2 109.596 -174.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . 0.407 ' HB2' ' HD3' ' A' ' 222' ' ' LYS . 10.2 t70 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 125.619 1.567 . . . . 72.13 109.707 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.5 m . . . . . 0 C--O 1.244 0.779 0 CA-C-O 120.625 0.25 . . . . 61.11 111.448 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.4 p -163.3 117.51 1.62 Allowed 'General case' 0 C--O 1.243 0.72 0 C-N-CA 123.344 0.658 . . . . 74.2 109.315 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -126.17 176.01 17.58 Favored Glycine 0 N--CA 1.423 -2.2 0 C-N-CA 120.068 -1.063 . . . . 73.14 112.785 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mp -82.43 150.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 N-CA-C 108.318 -0.993 . . . . 65.41 108.318 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 7.2 mp0 -52.85 141.04 22.65 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.284 1.033 . . . . 75.5 110.179 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.21 126.42 8.25 Favored Glycine 0 N--CA 1.426 -2.031 0 N-CA-C 107.994 -2.043 . . . . 54.31 107.994 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.8 p -65.67 116.45 6.9 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 117.358 0.579 . . . . 54.43 111.009 -177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.2 m -81.97 77.83 8.74 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-O 121.899 0.857 . . . . 72.44 109.367 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -137.19 132.71 34.28 Favored 'General case' 0 N--CA 1.426 -1.642 0 CA-C-N 114.991 -1.004 . . . . 73.12 108.661 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.484 ' OD1' ' HG3' ' A' ' 12' ' ' LYS . 24.2 t0 -139.59 124.13 18.25 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.992 -0.744 . . . . 55.13 108.992 175.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -89.33 -13.17 38.52 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.414 -0.812 . . . . 64.31 110.993 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.484 ' HG3' ' OD1' ' A' ' 10' ' ' ASP . 50.0 mttp -55.34 119.74 6.04 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.009 0.433 . . . . 70.23 111.544 -176.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -124.46 128.3 48.8 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.156 -0.683 . . . . 74.34 109.156 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -109.42 -34.3 6.57 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 120.263 -0.575 . . . . 74.54 111.425 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.8 m 61.54 78.57 0.28 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.966 0.791 . . . . 71.2 111.538 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.4 t -73.05 101.84 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.205 -0.907 . . . . 72.52 110.664 -176.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.7 p -91.92 143.36 11.48 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 CA-C-N 115.031 -0.986 . . . . 75.11 109.489 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.268 0.0 OUTLIER -89.22 141.66 28.33 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 112.957 0.725 . . . . 51.14 112.957 178.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.3 -162.17 36.52 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 114.871 -1.059 . . . . 51.41 113.31 -175.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 72.9 86.36 0.11 Allowed 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 125.368 1.467 . . . . 70.54 109.944 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.2 p -115.52 111.4 20.67 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.758 -1.11 . . . . 62.23 110.609 -176.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 24.6 m -145.57 83.08 1.65 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.0 -0.741 . . . . 70.33 109.0 176.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 19.3 t -96.72 57.98 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.735 0.779 . . . . 73.35 110.149 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 23' ' ' VAL . 25.9 tt0 165.32 161.05 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 104.698 -2.334 . . . . 73.43 104.698 176.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB3' ' NE2' ' A' ' 30' ' ' GLN . . . -146.02 152.72 39.81 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.404 -0.961 . . . . 74.54 108.404 176.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.518 ' HB2' ' OE2' ' A' ' 29' ' ' GLU . 66.6 m -82.98 173.0 12.17 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.625 -1.25 . . . . 65.23 107.625 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.534 HD12 ' ND1' ' A' ' 157' ' ' HIS . 88.5 mt -65.83 -22.68 66.57 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 114.659 1.355 . . . . 74.43 114.659 -172.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -53.19 42.3 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.964 -1.125 . . . . 64.22 107.964 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.518 ' OE2' ' HB2' ' A' ' 26' ' ' SER . 1.0 OUTLIER -80.61 -21.89 41.12 Favored 'General case' 0 N--CA 1.426 -1.663 0 CA-C-N 114.503 -1.226 . . . . 54.42 113.47 -175.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -69.82 -45.86 66.92 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.977 -0.749 . . . . 73.54 108.977 176.177 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.54 HD13 ' HE2' ' A' ' 82' ' ' LYS . 92.6 mt -69.26 -36.93 74.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.652 -0.703 . . . . 74.33 109.587 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.75 -37.38 78.83 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.729 . . . . 74.14 109.579 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -67.34 -43.51 81.39 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.545 -0.752 . . . . 71.03 110.14 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.83 -41.77 91.38 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.752 0.31 . . . . 75.34 110.169 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.62 -42.63 91.31 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.991 -0.55 . . . . 65.13 109.874 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -73.0 -26.49 61.35 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.891 -0.595 . . . . 63.31 110.23 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -68.49 -32.65 72.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.128 -0.693 . . . . 64.54 109.128 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.733 ' CZ ' ' HB3' ' A' ' 76' ' ' LYS . 55.2 t80 -82.52 -37.14 25.65 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.218 -0.446 . . . . 74.12 110.802 174.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -94.74 22.03 6.8 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 113.232 0.827 . . . . 74.35 113.232 -175.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -119.31 125.81 49.97 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.78 -1.192 . . . . 42.14 107.78 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -81.49 141.69 33.61 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 120.704 -0.398 . . . . 74.41 110.013 -176.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.9 pp -139.9 29.73 2.07 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.444 0.64 . . . . 73.45 110.007 175.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.9 m -68.53 -16.8 64.0 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.645 -0.707 . . . . 61.42 111.214 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -79.99 -2.35 43.63 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.361 0.6 . . . . 74.14 111.22 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -88.34 131.03 34.98 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 104.716 -2.327 . . . . 43.1 104.716 173.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -73.12 109.8 6.92 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.236 0.458 . . . . 74.31 112.236 -173.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.532 ' CB ' ' HG3' ' A' ' 99' ' ' ARG . 1.1 p -119.76 113.41 20.59 Favored 'General case' 0 N--CA 1.427 -1.581 0 N-CA-C 108.86 -0.793 . . . . 61.41 108.86 177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.0 m -123.35 86.89 2.65 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.551 -1.277 . . . . 62.12 107.551 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 53.79 79.1 0.14 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.007 1.323 . . . . 72.01 112.313 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.672 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 35.1 m0 -65.99 142.45 57.84 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.627 -0.715 . . . . 75.21 110.603 175.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 15.5 m120 -94.33 62.68 2.95 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 121.889 0.852 . . . . 74.02 109.12 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 2.1 m -76.96 -47.23 21.44 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.853 -1.536 . . . . 72.33 106.853 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.431 ' HA ' HG22 ' A' ' 56' ' ' VAL . 14.2 p-10 -59.98 -35.83 75.83 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 113.543 -1.662 . . . . 71.31 111.316 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 40.0 tt0 -69.33 -40.52 77.54 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 121.136 0.493 . . . . 71.32 111.04 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -73.11 -36.62 66.8 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.298 -0.561 . . . . 63.32 111.248 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.431 HG22 ' HA ' ' A' ' 53' ' ' ASP . 13.7 m -78.32 -18.54 13.56 Favored 'Isoleucine or valine' 0 C--O 1.166 -3.313 0 C-N-CA 119.036 -1.066 . . . . 71.54 110.276 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -67.97 -31.02 70.46 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 121.314 -0.866 . . . . 73.52 110.0 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -83.9 -40.3 18.75 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 115.762 -0.654 . . . . 74.41 110.862 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.0 tp -87.31 -27.97 22.54 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 112.983 0.735 . . . . 62.0 112.983 -174.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' O ' HD23 ' A' ' 60' ' ' LEU . 7.2 tt -129.84 -23.82 2.76 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 112.889 0.7 . . . . 73.33 112.889 -172.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' LEU 0.262 0.9 OUTLIER 91.44 165.38 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 126.325 1.85 . . . . 63.03 113.274 -175.969 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -5.7 39.44 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 115.309 1.596 . . . . 71.31 115.309 -172.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -61.59 -16.51 48.85 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 112.94 0.718 . . . . 63.11 112.94 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -113.3 12.87 18.98 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.529 0.937 . . . . 74.43 113.529 -176.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.53 125.86 10.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 121.404 0.621 . . . . 54.13 111.699 -177.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.43 40.08 1.68 Allowed Glycine 0 C--N 1.314 -0.65 0 N-CA-C 108.141 -1.984 . . . . 74.24 108.141 -173.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.496 HD12 ' H ' ' A' ' 67' ' ' ILE . 2.5 mp -63.18 -60.29 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.352 0 C-N-CA 124.663 1.185 . . . . 52.12 112.415 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.505 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.2 OUTLIER -64.2 -34.62 78.49 Favored 'General case' 0 C--O 1.209 -1.031 0 C-N-CA 119.695 -0.802 . . . . 70.54 111.03 -175.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m -67.68 -39.85 84.46 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 120.782 0.325 . . . . 34.34 110.496 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -70.13 -40.35 74.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.169 -0.678 . . . . 73.53 109.169 177.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 80.0 mt -59.61 -44.47 93.4 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 116.43 -0.35 . . . . 73.03 110.631 178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 68' ' ' GLU . 7.6 mp -59.7 -44.56 93.64 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 123.625 0.578 . . . . 71.02 110.892 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.06 -37.87 88.97 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 120.983 0.421 . . . . 71.12 111.904 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 70' ' ' ARG . 66.6 mt -73.64 -41.51 55.27 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 C-N-CA 120.457 -0.497 . . . . 73.11 109.962 178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.74 -40.93 92.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.853 -0.612 . . . . 64.42 110.909 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.733 ' HB3' ' CZ ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -63.02 -32.18 73.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.112 0.412 . . . . 43.11 112.112 176.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.45 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 45.2 mt-10 -80.57 -30.13 37.01 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.848 0.685 . . . . 74.52 112.848 177.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -69.0 -36.88 78.31 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 120.26 -0.576 . . . . 75.44 109.468 170.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -61.42 -48.81 79.51 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.072 -0.967 . . . . 72.32 108.807 176.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -63.02 -35.02 78.83 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.157 -0.474 . . . . 75.44 111.412 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 55.9 tp -74.13 -51.32 16.0 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.341 0.591 . . . . 71.14 110.776 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.54 ' HE2' HD13 ' A' ' 31' ' ' ILE . 33.3 mmtm -72.19 -21.53 61.41 Favored 'General case' 0 C--O 1.201 -1.489 0 N-CA-C 113.842 1.053 . . . . 75.25 113.842 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.443 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 32.9 p -68.65 -21.16 64.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.73 0.776 . . . . 74.32 110.938 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.48 -23.75 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 115.371 -0.831 . . . . 54.33 109.034 178.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.6 tp -98.2 -41.76 7.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 115.547 -0.751 . . . . 70.23 110.696 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 163' ' ' GLU . 85.5 m -93.62 133.28 37.12 Favored 'General case' 0 N--CA 1.428 -1.554 0 CA-C-O 121.138 0.494 . . . . 72.14 111.516 -177.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.6 m -71.57 131.8 43.76 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.241 -0.89 . . . . 75.24 110.643 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.3 10.98 76.52 Favored Glycine 0 CA--C 1.498 -1.03 0 C-N-CA 120.608 -0.806 . . . . 75.32 113.158 172.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.443 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 48.4 t -107.48 117.02 52.36 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 106.773 -1.566 . . . . 63.13 106.773 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -99.39 139.99 34.23 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 109.694 -0.484 . . . . 64.1 109.694 -177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -83.18 25.47 0.71 Allowed 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.13 0.49 . . . . 71.15 111.924 -176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 27.3 m -125.18 82.32 62.19 Favored Pre-proline 0 C--N 1.295 -1.776 0 O-C-N 121.7 -0.625 . . . . 73.43 109.64 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -93.9 135.13 0.96 Allowed 'Trans proline' 0 N--CA 1.443 -1.479 0 C-N-CA 122.562 2.175 . . . . 73.21 112.883 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.8 -33.84 7.86 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.664 -0.865 . . . . 65.44 108.664 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -88.71 98.05 11.48 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 114.953 -1.021 . . . . 63.12 108.298 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.4 t -114.49 135.76 53.26 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.419 0 CA-C-N 115.619 -0.718 . . . . 63.22 110.766 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.408 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -75.8 103.29 5.81 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.901 -1.148 . . . . 73.24 107.901 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -72.04 -21.3 61.56 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 121.214 0.53 . . . . 65.51 112.288 -174.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.672 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 35.9 mmt180 -137.2 125.15 22.71 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 116.171 -0.468 . . . . 61.03 110.799 -174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 63.9 t -102.85 120.03 52.08 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 107.068 -1.456 . . . . 44.31 107.068 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 141.13 98.09 Favored Pre-proline 0 C--N 1.309 -1.193 0 O-C-N 123.659 0.599 . . . . 73.12 109.575 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.37 -33.68 47.23 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.61 2.874 . . . . 63.24 114.223 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -71.01 -31.32 66.89 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.783 -0.527 . . . . 72.1 111.783 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -82.13 -33.62 29.55 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 109.4 -0.592 . . . . 72.34 109.4 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -57.45 -47.78 80.92 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.298 -0.864 . . . . 41.24 111.31 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.08 -35.93 73.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 120.365 -0.534 . . . . 65.03 110.785 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.478 ' O ' HG23 ' A' ' 111' ' ' VAL . 22.7 m -67.83 -43.32 79.82 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.75 -0.463 . . . . 63.31 109.75 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 88.7 mtp -64.83 -36.5 84.54 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 116.329 -0.396 . . . . 61.43 111.574 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 105' ' ' ALA . 8.1 mp -60.03 -43.73 95.11 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.923 0.392 . . . . 71.31 110.673 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -63.43 -43.72 96.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.237 -0.438 . . . . 64.31 110.712 174.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 107' ' ' SER . 57.2 t -65.26 -32.89 60.22 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 CA-C-N 116.281 -0.418 . . . . 63.04 111.211 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 108' ' ' MET . 92.1 mt -62.11 -42.49 99.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.332 0.587 . . . . 74.53 109.942 175.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.8 t -69.38 -29.91 67.78 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.785 -0.643 . . . . 53.05 109.962 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' ARG . 74.0 mt -80.61 -33.54 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 CA-C-N 116.502 -0.317 . . . . 70.22 111.131 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.509 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 7.7 p -73.31 -42.24 62.58 Favored 'General case' 0 C--N 1.306 -1.286 0 C-N-CA 120.75 -0.38 . . . . 65.22 110.704 177.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -66.57 -25.53 66.69 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.362 -1.348 . . . . 75.41 107.362 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 114' ' ' ILE . 35.5 ttm180 -65.17 -49.25 70.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.016 -0.993 . . . . 62.53 109.804 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.526 ' HB3' HD13 ' A' ' 27' ' ' LEU 0.334 2.4 pp20? -67.84 -33.28 74.45 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 119.672 -0.811 . . . . 74.21 113.046 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 119' ' ' LEU . 2.1 mm? -64.55 -43.8 92.81 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 119.72 -0.792 . . . . 71.45 110.862 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 14.1 p -71.64 -33.15 68.68 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.42 -0.512 . . . . 74.51 111.385 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 46.4 m -69.35 -42.32 75.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.559 -0.291 . . . . 75.41 111.131 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.669 ' HB3' ' CH2' ' A' ' 153' ' ' TRP . 4.5 pp -71.71 -37.16 70.68 Favored 'General case' 0 C--O 1.191 -1.994 0 C-N-CA 119.434 -0.906 . . . . 73.31 110.23 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 42.5 tptt -61.03 -45.85 93.12 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.227 0.33 . . . . 71.04 110.935 177.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.66 -37.41 87.23 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.283 0.563 . . . . 65.14 110.688 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -73.02 -39.02 66.33 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.116 -0.947 . . . . 60.13 109.486 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 122' ' ' LEU . 60.1 mt -57.73 -48.7 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 CA-C-N 115.834 -0.621 . . . . 65.54 110.376 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -68.72 -22.58 64.33 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 120.146 -0.622 . . . . 75.51 111.81 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -73.18 -56.89 4.49 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 108.018 -1.104 . . . . 74.15 108.018 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.516 ' HH2' ' HB2' ' A' ' 153' ' ' TRP 0.446 0.4 OUTLIER -78.46 -18.35 55.0 Favored 'General case' 0 C--O 1.211 -0.936 0 N-CA-C 115.837 1.792 . . . . 73.1 115.837 -177.556 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 130' ' ' LYS . 6.9 tmtm? -72.67 -26.48 61.64 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.27 -1.382 . . . . 62.21 107.27 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HB3' ' HE3' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -76.42 -23.73 54.0 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.094 -0.957 . . . . 41.41 109.46 175.374 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.1 t -73.6 131.97 34.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.406 -0.961 . . . . 54.11 108.406 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -88.94 -170.38 2.88 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.109 -0.7 . . . . 64.42 109.109 -177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.01 98.65 1.32 Allowed 'General case' 0 N--CA 1.425 -1.677 0 N-CA-C 108.169 -1.049 . . . . 62.3 108.169 174.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -60.95 125.18 22.76 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.306 -0.998 . . . . 64.12 108.306 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 1.5 pm0 -63.6 1.23 0.61 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.263 1.208 . . . . 75.2 114.263 -176.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.87 -21.81 64.23 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.576 -0.738 . . . . 74.1 109.339 170.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 123.97 12.74 4.3 Favored Glycine 0 N--CA 1.437 -1.261 0 CA-C-N 115.231 -0.895 . . . . 54.31 112.684 -177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.8 m -84.07 162.4 20.34 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.018 -1.104 . . . . 72.32 108.018 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -107.59 178.65 4.47 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.148 -1.427 . . . . 63.33 107.148 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.6 m -75.95 139.61 18.67 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 106.428 -1.693 . . . . 75.33 106.428 170.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.474 HG21 ' CD1' ' A' ' 129' ' ' TRP . 48.2 mm -75.58 97.87 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 CA-C-O 122.606 1.193 . . . . 62.24 112.158 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -120.98 -47.1 2.3 Favored 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.816 -1.538 . . . . 75.34 110.924 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -97.79 148.45 23.37 Favored 'General case' 0 CA--C 1.498 -1.024 0 C-N-CA 120.88 -0.328 . . . . 72.55 110.871 -178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 11.3 tt -67.34 -17.24 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 115.407 -0.815 . . . . 73.21 113.188 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -94.64 20.54 8.42 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.263 1.208 . . . . 64.43 114.263 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.21 155.45 23.7 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.235 -1.024 . . . . 72.44 108.235 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -58.1 -34.92 70.71 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.384 0.674 . . . . 64.33 110.666 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -67.81 -48.43 66.26 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 116.389 -0.369 . . . . 75.35 110.556 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.442 HG21 HD21 ' A' ' 169' ' ' LEU . 6.7 p -68.92 -36.99 78.64 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 120.805 -0.358 . . . . 71.51 110.32 -178.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' ' 155' ' ' VAL . 94.8 m-20 -60.86 -41.65 96.32 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.391 -0.822 . . . . 60.44 110.444 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 18.2 p -61.31 -32.6 72.45 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.513 0.931 . . . . 74.22 113.513 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.669 ' CH2' ' HB3' ' A' ' 122' ' ' LEU . 56.1 t90 -76.09 -44.33 39.3 Favored 'General case' 0 CA--C 1.502 -0.899 0 C-N-CA 119.778 -0.769 . . . . 75.05 109.757 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.423 ' HD1' ' O ' ' A' ' 150' ' ' THR . 36.1 m-85 -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.512 -0.767 . . . . 72.32 111.903 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 159' ' ' PHE . 27.2 m -65.29 -33.23 62.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.196 0.443 . . . . 55.11 112.196 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.76 96.06 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.183 0.516 . . . . 64.23 110.299 177.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.534 ' ND1' HD12 ' A' ' 27' ' ' LEU . 10.9 m170 -79.14 -8.95 59.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 113.526 0.935 . . . . 75.15 113.526 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.05 -11.32 14.89 Favored Glycine 0 CA--C 1.499 -0.924 0 C-N-CA 120.515 -0.85 . . . . 53.53 112.539 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 155' ' ' VAL . 41.2 m-85 -73.86 113.94 11.59 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 109.555 -0.535 . . . . 73.44 109.555 -177.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.545 ' HB3' ' OE1' ' A' ' 163' ' ' GLU . 62.7 tttm -86.01 145.92 26.88 Favored 'General case' 0 C--N 1.279 -2.473 0 N-CA-C 106.762 -1.569 . . . . 74.25 106.762 173.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.55 -25.96 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.664 0.616 . . . . 72.55 112.664 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -67.8 -34.98 77.81 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 116.506 -0.316 . . . . 73.35 111.423 177.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.545 ' OE1' ' HB3' ' A' ' 160' ' ' LYS . 2.4 mp0 -82.48 -8.31 59.62 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 112.843 0.683 . . . . 74.23 112.843 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -109.49 132.47 54.1 Favored 'General case' 0 C--N 1.294 -1.835 0 C-N-CA 120.266 -0.574 . . . . 75.41 109.864 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.61 159.8 15.13 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.159 -0.616 . . . . 73.22 110.282 -176.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -64.35 130.52 44.11 Favored 'General case' 0 C--O 1.249 1.045 0 CA-C-O 121.792 0.805 . . . . 64.14 112.93 -175.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 13.5 p -164.42 157.05 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.574 0 N-CA-C 106.017 -1.845 . . . . 74.33 106.017 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 3.6 p -86.98 144.0 27.1 Favored 'General case' 0 N--CA 1.417 -2.12 0 N-CA-C 109.688 -0.486 . . . . 71.12 109.688 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.442 HD21 HG21 ' A' ' 150' ' ' THR . 3.0 mm? -65.8 -34.24 77.72 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.118 0.485 . . . . 71.43 110.084 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -69.6 -31.91 70.32 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.069 -0.969 . . . . 75.23 111.555 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -79.2 -40.73 30.02 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 109.338 -0.616 . . . . 74.31 109.338 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.65 -41.14 97.1 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.244 -1.021 . . . . 74.12 108.244 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . 0.412 ' HA ' HG12 ' A' ' 176' ' ' VAL . . . -62.94 -39.23 93.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.565 -0.743 . . . . 75.43 110.879 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.6 m -65.46 -43.78 89.26 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.657 0.265 . . . . 73.34 111.263 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.05 -35.94 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 C-N-CA 119.584 -0.846 . . . . 63.22 111.008 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 173' ' ' ALA . 13.6 p -76.48 -35.29 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 C-N-CA 119.551 -0.86 . . . . 61.12 111.278 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 181' ' ' SER . 56.8 t30 -64.82 -32.59 74.36 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 109.599 -0.519 . . . . 72.33 109.599 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -73.65 -40.4 63.76 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 115.937 -0.574 . . . . 63.12 109.715 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 8.1 tt -66.32 -42.55 88.06 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.092 -0.504 . . . . 75.13 111.115 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' A' ' 177' ' ' ASN . 28.4 m -77.46 -15.08 14.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 O-C-N 121.842 -0.537 . . . . 61.43 111.735 -177.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 177' ' ' ASN . 10.9 t -82.32 -15.01 54.41 Favored 'General case' 0 C--O 1.255 1.379 0 N-CA-C 113.059 0.763 . . . . 50.14 113.059 -177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 184' ' ' ASP 0.261 19.2 p80 -73.42 139.86 46.16 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 117.702 -1.599 . . . . 74.24 111.387 -175.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -58.92 -32.78 69.86 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.298 -0.865 . . . . 74.4 112.82 -172.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.489 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 12.5 t70 -65.44 -35.67 81.62 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.318 -0.401 . . . . 75.23 110.772 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 15.3 tpt -77.38 -34.1 55.04 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.801 -0.636 . . . . 63.1 109.428 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 47.9 mm -59.49 -43.13 89.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.338 0 CA-C-N 115.631 -0.713 . . . . 72.14 109.23 176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -59.94 -47.15 86.95 Favored 'General case' 0 C--O 1.212 -0.895 0 O-C-N 123.358 0.411 . . . . 73.42 110.325 176.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 184' ' ' ASP . 46.2 mm -59.32 -45.33 93.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 O-C-N 123.578 0.549 . . . . 70.43 111.066 -176.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . 0.554 ' OD1' ' HE3' ' A' ' 193' ' ' LYS . 39.7 t-20 -73.29 -36.2 66.25 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 63.34 109.409 -176.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.35 -42.35 96.29 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.274 0.559 . . . . 72.53 110.444 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -66.68 -40.28 88.49 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.529 -0.759 . . . . 52.25 109.982 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -45.1 91.59 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.349 -0.387 . . . . 75.13 110.52 177.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.554 ' HE3' ' OD1' ' A' ' 189' ' ' ASN . 93.8 mttt -58.93 -45.53 90.19 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 123.15 0.281 . . . . 71.04 111.384 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -68.81 -38.17 79.73 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.611 -0.435 . . . . 63.21 111.785 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.416 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 42.1 m-80 -74.44 -40.84 61.68 Favored 'General case' 0 N--CA 1.427 -1.608 0 C-N-CA 119.877 -0.729 . . . . 74.4 112.227 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.77 -25.45 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 C-N-CA 119.994 -0.682 . . . . 50.31 110.173 -177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.83 -48.03 73.01 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-N 116.433 -0.349 . . . . 45.11 110.062 176.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -71.2 -38.67 72.06 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.954 -0.566 . . . . 63.41 110.77 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 49.0 m0 -67.16 -34.62 77.94 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.226 -0.443 . . . . 72.34 112.124 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 80.9 m -69.3 -37.33 77.75 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.481 -0.488 . . . . 74.4 109.694 176.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -65.87 -42.1 90.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.081 -0.509 . . . . 71.11 110.409 177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -66.41 -41.93 88.55 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.493 -0.321 . . . . 73.25 110.991 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.14 -39.9 93.66 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 116.315 -0.402 . . . . 75.22 110.884 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 13.0 p -68.67 -38.42 80.37 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 112.071 0.397 . . . . 40.52 112.071 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -74.72 -39.91 61.61 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.232 -0.587 . . . . 63.31 110.434 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -70.23 -37.3 74.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.459 -0.337 . . . . 62.01 111.172 -177.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.73 -42.62 90.84 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.683 -0.488 . . . . 73.22 109.683 179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -69.42 -35.36 75.65 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 116.184 -0.462 . . . . 60.44 110.338 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 26.1 ttt -65.43 -44.92 85.83 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.021 -0.536 . . . . 64.4 109.962 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 27.0 ttt -60.75 -43.32 98.09 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.967 -0.561 . . . . 72.51 110.044 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.07 -37.65 84.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.793 -0.64 . . . . 63.55 111.152 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -74.4 -41.67 60.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.383 -0.371 . . . . 74.41 111.606 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . 0.659 ' HA ' HE21 ' A' ' 213' ' ' GLN . 0.0 OUTLIER -69.41 -53.44 19.36 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.849 -0.34 . . . . 74.14 110.412 179.204 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -179.98 103.19 0.17 Allowed Glycine 0 N--CA 1.422 -2.287 0 C-N-CA 120.068 -1.063 . . . . 32.32 111.365 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 7.0 tp -78.69 103.43 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.304 0 N-CA-C 108.27 -1.011 . . . . 71.44 108.27 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 21.9 t -147.97 164.23 34.4 Favored 'General case' 0 N--CA 1.42 -1.956 0 N-CA-C 107.95 -1.13 . . . . 73.32 107.95 -174.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 111.4 112.41 3.3 Favored Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 111.103 -0.799 . . . . 74.43 111.103 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -85.34 14.33 5.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.085 0.469 . . . . 65.51 111.401 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -93.68 162.47 13.93 Favored 'General case' 0 C--O 1.25 1.094 0 CA-C-O 121.441 0.639 . . . . 74.44 110.644 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -161.24 -175.17 31.97 Favored Glycine 0 N--CA 1.417 -2.588 0 N-CA-C 107.429 -2.268 . . . . 53.45 107.429 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 221' ' ' LYS . 11.4 mmmt -114.31 95.8 5.46 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 122.014 0.911 . . . . 75.04 113.358 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -102.03 126.05 48.87 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 113.734 -1.575 . . . . 63.12 106.965 174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 . . . . . 0 C--O 1.244 0.811 0 O-C-N 124.304 1.003 . . . . 73.11 109.881 -178.538 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 120.801 0.334 . . . . 72.22 110.311 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 m -152.0 176.76 11.17 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.302 -0.999 . . . . 64.44 108.302 178.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 114.67 178.65 18.89 Favored Glycine 0 N--CA 1.437 -1.277 0 C-N-CA 120.782 -0.723 . . . . 63.55 111.455 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tt -136.56 131.87 48.13 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 CA-C-O 121.196 0.522 . . . . 55.22 110.865 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -123.68 74.65 1.28 Allowed 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 107.97 -1.122 . . . . 72.4 107.97 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -92.21 32.28 5.53 Favored Glycine 0 C--N 1.309 -0.965 0 CA-C-N 115.783 -0.644 . . . . 71.14 112.804 -175.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 p -94.53 105.97 17.94 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 121.127 0.489 . . . . 71.51 110.427 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.4 t -144.02 88.6 1.97 Allowed 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 107.528 -1.286 . . . . 72.34 107.528 175.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -135.15 131.15 36.46 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.281 -0.872 . . . . 73.41 110.376 -172.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -94.29 161.16 14.36 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.665 -0.698 . . . . 64.5 109.716 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.91 -59.67 2.6 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.827 -0.805 . . . . 74.04 108.827 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.6 mttp 179.5 170.05 1.06 Allowed 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 127.868 2.467 . . . . 74.52 104.413 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -110.76 81.12 1.38 Allowed 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 107.287 -1.375 . . . . 71.41 107.287 167.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.02 -41.87 97.3 Favored 'General case' 0 CA--C 1.481 -1.706 0 CA-C-N 114.292 -1.322 . . . . 65.34 111.208 -174.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 55.86 87.68 0.05 Allowed 'General case' 0 N--CA 1.439 -1.005 0 O-C-N 124.905 1.378 . . . . 63.23 110.907 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -79.87 91.3 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.774 -0.825 . . . . 73.2 108.774 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.25 121.01 41.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.318 0 CA-C-O 121.723 0.773 . . . . 62.22 111.403 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -115.01 105.22 12.71 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.31 -0.996 . . . . 73.21 108.31 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.56 104.28 1.34 Allowed Glycine 0 N--CA 1.439 -1.15 0 O-C-N 123.514 0.509 . . . . 52.33 112.199 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.44 115.7 21.58 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 109.422 -0.585 . . . . 73.44 109.422 179.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.9 m -156.28 129.7 8.2 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.276 -1.379 . . . . 53.33 107.276 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.8 m -77.88 81.42 4.29 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.256 0.55 . . . . 54.12 111.708 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.42 HG12 ' OE2' ' A' ' 24' ' ' GLU . 13.1 t -102.31 121.24 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 106.097 -1.816 . . . . 52.4 106.097 177.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' HG12 ' A' ' 23' ' ' VAL . 1.7 mp0 76.16 111.58 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.805 1.242 . . . . 51.12 110.267 -171.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.62 175.99 6.62 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.9 -0.591 . . . . 62.32 109.876 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 5.8 m -81.26 163.11 23.21 Favored 'General case' 0 N--CA 1.413 -2.3 0 N-CA-C 106.581 -1.637 . . . . 61.03 106.581 178.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.506 HD13 ' HB3' ' A' ' 118' ' ' GLU . 55.2 mt -72.86 -19.65 61.26 Favored 'General case' 0 C--N 1.285 -2.206 0 C-N-CA 120.214 -0.594 . . . . 73.32 112.056 -175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' HG3' ' HA ' ' A' ' 159' ' ' PHE . 0.1 OUTLIER -68.4 -51.42 44.2 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.102 -1.444 . . . . 70.24 107.102 179.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.24 -32.81 72.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.631 -0.713 . . . . 62.21 111.102 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -70.16 -41.35 73.93 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.246 -0.434 . . . . 65.24 110.36 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 27' ' ' LEU . 87.7 mt -67.32 -37.61 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.711 -0.848 . . . . 53.04 108.711 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.34 -35.53 79.39 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.122 -0.945 . . . . 53.24 110.751 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 88.3 t90 -72.34 -39.07 68.44 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 120.937 0.399 . . . . 75.42 110.186 178.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.0 tp -63.14 -41.29 99.27 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.18 -0.674 . . . . 71.03 109.18 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.4 91.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.21 -0.905 . . . . 62.31 109.775 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -58.55 -45.74 88.32 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 123.766 0.827 . . . . 52.34 110.292 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -59.37 -40.19 85.68 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.78 0.324 . . . . 63.42 111.054 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 76' ' ' LYS . 41.9 t80 -76.16 -31.7 58.7 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 112.327 0.491 . . . . 63.44 112.327 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.5 m -99.83 20.99 13.19 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 123.052 0.541 . . . . 73.31 112.405 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -112.42 130.17 56.07 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 112.101 0.408 . . . . 74.51 112.101 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 95' ' ' HIS . 11.6 t70 -82.91 130.04 35.09 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.562 -0.903 . . . . 55.42 108.562 173.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -130.4 29.23 4.87 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.186 0.517 . . . . 64.3 110.169 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 m -67.33 -16.33 64.2 Favored 'General case' 0 CA--C 1.555 1.165 0 CA-C-N 115.446 -0.797 . . . . 72.11 111.039 -176.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -67.04 -20.95 65.93 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.311 1.053 . . . . 75.51 109.347 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -90.47 118.3 29.83 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 106.29 -1.744 . . . . 54.35 106.29 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -84.39 97.59 9.58 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.986 -1.116 . . . . 44.31 107.986 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.637 HG21 ' HG3' ' A' ' 99' ' ' ARG . 42.6 p -65.4 93.39 0.15 Allowed 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.12 0.962 . . . . 75.04 112.517 -175.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 m -90.62 86.5 6.4 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-N 114.253 -1.34 . . . . 75.45 109.272 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 86.7 tttt 45.57 73.24 0.17 Allowed 'General case' 0 C--O 1.245 0.845 0 C-N-CA 125.791 1.636 . . . . 74.42 113.587 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CE2' HG22 ' A' ' 47' ' ' THR . 33.6 m0 -70.63 126.89 30.86 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.944 -0.571 . . . . 71.52 109.882 175.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -106.03 62.77 0.66 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.204 1.002 . . . . 73.21 110.123 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.8 m -82.93 -40.96 19.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.646 -1.161 . . . . 74.4 109.757 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' HA ' HG22 ' A' ' 56' ' ' VAL . 10.2 p-10 -65.28 -28.27 69.21 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.704 0.764 . . . . 62.23 109.139 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -72.06 -37.39 69.65 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.651 -1.159 . . . . 60.01 110.254 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.18 -42.87 65.35 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.875 0.369 . . . . 72.3 110.686 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.498 HG21 ' HB ' ' A' ' 67' ' ' ILE . 33.1 m -74.09 -22.48 18.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.731 0 C-N-CA 118.892 -1.123 . . . . 52.22 112.498 -175.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 61' ' ' ASN . 22.2 pttp -74.0 -19.53 60.61 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 118.776 -1.17 . . . . 73.2 110.825 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.99 -29.03 13.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 118.983 -1.087 . . . . 75.41 111.901 175.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -80.95 -43.25 20.01 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.484 0.55 . . . . 73.31 112.484 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.526 ' O ' HD23 ' A' ' 60' ' ' LEU . 5.4 tt -109.57 -14.21 14.41 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.046 -0.353 . . . . 74.04 110.046 -173.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 57' ' ' LYS 0.268 5.0 m-20 90.2 178.07 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.67 1.588 . . . . 65.12 112.193 -177.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.31 -5.73 15.54 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 116.049 1.87 . . . . 72.34 116.049 -170.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -80.5 -5.48 56.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.472 -0.767 . . . . 75.43 111.411 174.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' HB2' HD22 ' A' ' 60' ' ' LEU . . . -94.91 12.86 26.79 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.1 -0.5 . . . . 41.41 111.464 178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.4 m -63.08 145.1 13.89 Favored 'Isoleucine or valine' 0 C--O 1.259 1.596 0 CA-C-O 121.589 0.709 . . . . 75.52 112.375 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.07 43.93 94.99 Favored Glycine 0 C--N 1.311 -0.857 0 CA-C-N 114.006 -1.452 . . . . 73.11 110.479 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.498 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.0 tp -66.96 -32.95 60.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 112.951 0.722 . . . . 73.15 112.951 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -37.97 88.47 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 120.756 0.312 . . . . 65.41 111.624 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.3 m -82.54 -30.93 29.4 Favored 'General case' 0 N--CA 1.41 -2.429 0 C-N-CA 119.912 -0.715 . . . . 62.41 109.712 176.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -61.02 -52.8 63.44 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 123.53 0.732 . . . . 70.21 110.469 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.9 mt -66.14 -35.1 79.58 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.748 -0.66 . . . . 61.32 111.565 -174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 3.2 mm? -80.62 -24.25 39.19 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.753 -1.179 . . . . 72.35 112.213 178.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.44 67.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.48 -0.563 . . . . 60.21 109.48 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 64.1 mt -70.18 -36.98 70.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.632 -0.507 . . . . 63.34 109.632 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.15 -43.35 99.03 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 109.061 -0.718 . . . . 73.02 109.061 175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.456 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . 11.8 tmtt? -54.36 -43.78 71.61 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 124.485 1.114 . . . . 74.3 111.413 173.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -64.14 -40.96 97.28 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.666 -0.243 . . . . 74.01 111.321 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -68.78 -43.3 76.0 Favored 'General case' 0 C--O 1.21 -0.989 0 C-N-CA 119.989 -0.684 . . . . 61.35 110.438 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -59.67 -48.04 83.25 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 124.096 0.958 . . . . 72.41 110.369 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.462 ' HA ' ' HB3' ' A' ' 91' ' ' GLU . 55.7 tttm -67.28 -36.26 81.2 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.259 0.552 . . . . 74.4 111.82 -177.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.255 8.1 mp -85.03 -29.46 24.95 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 113.569 0.951 . . . . 74.15 113.569 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -84.4 -21.21 30.88 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.128 0.418 . . . . 74.14 112.128 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 78.2 p -57.86 -38.56 75.93 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.435 0.694 . . . . 62.42 111.58 -177.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 37.5 t -69.11 -22.09 25.84 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.67 0.748 . . . . 53.44 110.042 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 85' ' ' LEU . 8.1 tt -99.17 -14.71 19.21 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.21 -0.904 . . . . 71.01 112.015 -175.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 58.4 m -113.02 143.83 43.63 Favored 'General case' 0 C--N 1.31 -1.15 0 O-C-N 121.785 -0.572 . . . . 74.22 110.225 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 22.4 p -81.13 128.84 34.2 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.139 0.495 . . . . 75.02 111.879 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.35 -11.68 67.11 Favored Glycine 0 CA--C 1.506 -0.513 0 CA-C-N 115.81 -0.632 . . . . 53.14 113.146 176.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 58.4 t -91.72 112.26 25.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 N-CA-C 109.37 -0.604 . . . . 74.53 109.37 -177.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -108.61 146.62 33.07 Favored 'General case' 0 CA--C 1.471 -2.086 0 C-N-CA 120.862 -0.335 . . . . 73.42 110.669 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.8 OUTLIER -77.52 8.45 4.28 Favored 'General case' 0 C--N 1.294 -1.826 0 C-N-CA 124.872 1.269 . . . . 72.23 112.934 -173.744 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 t -123.23 81.48 52.13 Favored Pre-proline 0 N--CA 1.418 -2.054 0 CA-C-O 121.972 0.892 . . . . 73.33 109.291 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -79.24 156.06 25.72 Favored 'Trans proline' 0 N--CA 1.445 -1.355 0 C-N-CA 122.45 2.1 . . . . 72.01 111.371 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.03 -43.11 8.29 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.043 -1.095 . . . . 61.51 108.043 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.41 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 34.3 m170 -97.93 105.55 17.72 Favored 'General case' 0 N--CA 1.406 -2.645 0 CA-C-N 114.168 -1.378 . . . . 72.53 108.481 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.3 t -117.13 124.53 73.12 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.622 0 CA-C-N 115.268 -0.878 . . . . 71.51 110.099 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -91.45 147.75 22.8 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.969 -0.752 . . . . 72.44 108.969 174.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -138.96 35.33 2.15 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 107.219 -1.4 . . . . 75.23 107.219 176.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.637 ' HG3' HG21 ' A' ' 47' ' ' THR . 56.6 mmt-85 -132.57 120.26 21.61 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.436 -1.257 . . . . 73.45 108.353 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 18.3 t -114.82 129.63 70.63 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 108.518 -0.919 . . . . 73.33 108.518 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.9 m -73.06 153.69 90.74 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.702 -0.481 . . . . 74.24 109.702 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -52.83 -29.6 43.64 Favored 'Trans proline' 0 CA--C 1.55 1.295 0 C-N-CA 123.327 2.685 . . . . 74.54 113.771 177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -89.45 -36.13 7.62 Favored Glycine 0 C--O 1.247 0.961 0 N-CA-C 111.732 -0.547 . . . . 71.31 111.732 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.42 -39.32 94.16 Favored 'General case' 0 CA--C 1.486 -1.504 0 N-CA-C 109.965 -0.383 . . . . 72.05 109.965 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.521 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -55.5 -48.4 74.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 123.945 0.778 . . . . 70.15 110.976 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.8 mm -65.38 -40.08 87.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.783 -0.644 . . . . 75.14 109.702 -178.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.462 ' O ' HG23 ' A' ' 111' ' ' VAL . 19.3 m -67.05 -43.07 83.68 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.428 -0.806 . . . . 72.12 110.387 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.504 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 91.0 mtp -67.0 -36.28 81.82 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 116.609 -0.269 . . . . 71.05 110.854 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.702 ' HB3' ' SD ' ' A' ' 192' ' ' MET . 91.0 mt -59.13 -48.43 81.62 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 123.482 0.489 . . . . 54.11 110.213 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -66.34 -36.8 83.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.166 -0.47 . . . . 74.13 111.247 178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' SER . 70.4 t -62.77 -44.06 99.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 CA-C-N 116.535 -0.302 . . . . 64.14 110.404 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 108' ' ' MET . 90.4 mt -60.05 -34.18 73.06 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.103 0.478 . . . . 74.21 111.308 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.7 t -69.8 -42.62 73.47 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 109.777 -0.453 . . . . 65.52 109.777 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.5 mt -70.32 -35.95 64.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.302 -0.408 . . . . 74.1 111.003 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 22.6 p -70.08 -31.67 69.37 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-O 120.9 0.381 . . . . 60.01 110.418 177.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -72.2 -26.88 62.22 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.724 -0.843 . . . . 64.43 108.724 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -65.51 -44.17 87.8 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.56 -0.291 . . . . 73.21 110.914 174.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.506 ' HB3' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -68.01 -39.09 83.24 Favored 'General case' 0 C--O 1.194 -1.823 0 C-N-CA 119.053 -1.059 . . . . 73.43 110.207 176.707 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 32.9 tp -61.5 -44.58 96.82 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 123.286 0.634 . . . . 55.22 111.159 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.482 ' HA ' ' HG2' ' A' ' 123' ' ' LYS . 13.6 p -70.55 -30.76 67.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 120.928 0.394 . . . . 71.3 111.508 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.2 t -75.92 -42.13 49.82 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.812 -0.81 . . . . 71.1 108.812 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.45 ' HB2' ' CH2' ' A' ' 153' ' ' TRP . 7.2 tt -59.49 -47.38 85.72 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.643 1.177 . . . . 71.33 110.345 179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 120' ' ' SER . 19.5 ptmt -67.76 -31.64 71.69 Favored 'General case' 0 CA--C 1.502 -0.895 0 C-N-CA 119.937 -0.705 . . . . 54.33 110.973 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -72.25 -44.56 62.67 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.809 -0.441 . . . . 71.14 109.809 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 153' ' ' TRP . 14.4 mmmm -70.35 -40.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.724 -0.473 . . . . 72.13 109.724 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.553 HG23 HD12 ' A' ' 169' ' ' LEU . 10.5 mt -65.68 -39.81 86.03 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.691 -0.686 . . . . 72.1 111.757 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.12 -37.18 86.62 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.943 0.401 . . . . 65.34 110.103 179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -62.96 -49.1 76.06 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.645 -0.707 . . . . 74.24 111.615 176.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.618 ' O ' HG12 ' A' ' 132' ' ' VAL 0.448 1.8 p90 -78.54 -18.68 54.35 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 115.243 1.571 . . . . 52.14 115.243 177.599 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -71.13 -31.01 67.2 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.436 -0.95 . . . . 74.5 108.436 172.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -81.14 -10.97 59.56 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 115.666 -0.697 . . . . 75.04 111.86 179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 129' ' ' TRP . 4.2 p -86.85 144.08 10.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 107.618 -1.253 . . . . 71.43 107.618 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -132.12 -177.2 4.34 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-O 121.292 0.568 . . . . 75.43 110.903 -175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -76.91 118.44 19.5 Favored 'General case' 0 N--CA 1.424 -1.764 0 CA-C-N 114.883 -1.053 . . . . 43.4 109.242 176.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.2 m -126.79 137.76 53.26 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 106.343 -1.725 . . . . 74.41 106.343 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -15.62 13.31 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.208 1.188 . . . . 74.54 114.208 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -66.48 -22.03 66.19 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.869 -0.605 . . . . 74.24 110.888 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 122.45 12.95 4.92 Favored Glycine 0 C--N 1.308 -0.982 0 C-N-CA 120.786 -0.721 . . . . 75.44 112.478 -177.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 3.8 m -83.39 125.4 31.64 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.215 -1.402 . . . . 73.03 107.215 176.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -100.33 169.09 9.35 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 120.733 0.301 . . . . 54.44 111.688 -172.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 15.9 m -95.76 132.6 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.175 0 N-CA-C 108.802 -0.814 . . . . 53.14 108.802 174.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.458 HD12 ' HB2' ' A' ' 129' ' ' TRP . 65.0 mt -99.61 94.24 3.47 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.514 0 CA-C-O 121.992 0.901 . . . . 71.05 109.573 177.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -100.33 -31.85 11.13 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.124 -1.398 . . . . 64.33 111.928 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -110.01 147.64 33.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.244 -0.582 . . . . 75.4 112.024 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.639 ' O ' ' HB ' ' A' ' 150' ' ' THR . 13.1 tt -62.86 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.534 -0.757 . . . . 75.44 111.489 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -92.1 44.52 1.17 Allowed 'General case' 0 C--O 1.246 0.886 0 CA-C-O 121.616 0.722 . . . . 72.32 110.908 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -103.7 157.28 17.18 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 107.401 -1.333 . . . . 61.31 107.401 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -46.79 -49.23 20.2 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.894 1.278 . . . . 61.5 113.333 -172.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -78.55 -35.42 46.07 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.876 -0.73 . . . . 73.51 111.358 -175.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.1 OUTLIER -68.53 -44.08 75.37 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 109.27 -0.641 . . . . 72.04 109.27 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.495 ' O ' HG22 ' A' ' 155' ' ' VAL . 80.9 m-20 -56.3 -46.03 79.96 Favored 'General case' 0 CA--C 1.489 -1.403 0 CA-C-N 115.573 -0.74 . . . . 74.23 109.983 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.3 p -59.86 -31.12 69.47 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.92 1.082 . . . . 63.22 113.92 -177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 125' ' ' LYS . 78.8 t90 -81.72 -42.85 19.26 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 119.67 -0.812 . . . . 71.14 109.705 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -65.25 -46.68 79.56 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 115.447 -0.797 . . . . 73.01 111.991 -177.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 151' ' ' ASN . 26.8 m -64.85 -31.65 54.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 111.983 0.364 . . . . 61.41 111.983 -179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.1 -42.93 93.55 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.939 -0.573 . . . . 53.03 110.047 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -75.56 -11.37 60.01 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 114.027 1.121 . . . . 61.44 114.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 116.9 -10.54 15.55 Favored Glycine 0 C--N 1.307 -1.07 0 C-N-CA 119.785 -1.198 . . . . 64.25 112.46 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.522 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 73.8 m-85 -73.91 100.7 3.58 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 108.217 -1.031 . . . . 75.12 108.217 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.42 ' HE3' ' HB2' ' A' ' 160' ' ' LYS . 37.9 ttmt -83.66 152.19 24.89 Favored 'General case' 0 C--N 1.277 -2.552 0 N-CA-C 107.905 -1.146 . . . . 61.15 107.905 -178.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 51.8 t -56.16 -35.42 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.326 0.65 . . . . 62.4 112.645 -173.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.95 -20.47 41.92 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.794 0.331 . . . . 63.12 111.733 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -84.83 -37.96 20.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.098 0.475 . . . . 75.14 109.965 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 pp -88.94 147.69 24.19 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 121.586 0.708 . . . . 72.11 110.261 -179.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -101.47 144.07 30.7 Favored 'General case' 0 C--N 1.279 -2.494 0 C-N-CA 124.499 1.119 . . . . 60.02 108.637 -174.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -75.08 130.7 39.73 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.292 0.568 . . . . 63.34 110.83 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.529 ' H ' HG22 ' A' ' 145' ' ' ILE . 7.5 p -157.53 161.9 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 106.443 -1.688 . . . . 74.02 106.443 -179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 46.2 p -86.84 151.86 22.97 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 112.609 0.596 . . . . 52.23 112.609 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 126' ' ' ILE . 4.2 mm? -65.08 -27.41 68.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.25 -0.887 . . . . 72.43 109.861 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -66.65 -46.36 76.02 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 115.413 -0.812 . . . . 74.44 108.821 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -69.55 -38.53 77.49 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 119.614 -0.834 . . . . 71.53 110.834 176.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 86.0 mt -61.76 -45.15 95.13 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 116.32 -0.4 . . . . 70.4 111.558 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.77 95.67 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.806 -0.358 . . . . 73.35 111.806 -177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.6 t -75.17 -35.63 61.57 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 118.868 -1.133 . . . . 75.02 111.535 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.33 -41.68 65.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.316 -0.402 . . . . 51.04 111.174 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 95.2 t -70.89 -35.29 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 120.611 -0.436 . . . . 72.41 110.19 -178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.63 -38.04 88.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.134 0.492 . . . . 45.1 109.861 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.38 -41.55 89.25 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.336 -0.847 . . . . 73.23 110.457 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.1 tt -67.98 -42.54 80.67 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 120.908 0.385 . . . . 63.31 110.005 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 33.3 m -77.95 -17.95 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 N-CA-C 112.611 0.597 . . . . 61.1 112.611 -175.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 8.0 t -101.98 4.11 39.62 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.329 0.585 . . . . 44.34 109.461 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 -65.5 127.09 30.41 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.831 -0.803 . . . . 63.15 108.831 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -63.71 -32.42 73.91 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 114.529 1.307 . . . . 74.44 114.529 -173.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 188' ' ' ILE . 10.3 t70 -80.36 -44.93 18.62 Favored 'General case' 0 CA--C 1.496 -1.122 0 C-N-CA 118.74 -1.184 . . . . 74.12 108.74 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 2.3 tpt -60.3 -46.96 88.03 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.452 -1.249 . . . . 72.34 111.589 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.1 tt -66.15 -34.98 73.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.35 -0.54 . . . . 62.24 111.132 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -71.5 -43.74 65.97 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 120.077 -0.649 . . . . 74.11 110.509 178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 184' ' ' ASP . 45.5 mm -63.56 -37.94 80.93 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.187 0 CA-C-N 116.35 -0.386 . . . . 62.11 110.038 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.51 -44.8 93.23 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.631 -0.259 . . . . 60.21 111.261 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -67.83 -38.36 83.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.789 0.328 . . . . 72.1 111.238 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -67.46 -46.13 73.94 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.004 -0.739 . . . . 54.21 109.004 177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.702 ' SD ' ' HB3' ' A' ' 109' ' ' LEU . 0.3 OUTLIER -60.45 -38.43 84.13 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-N 115.365 -0.834 . . . . 72.1 110.078 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.14 -41.98 84.85 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 124.197 0.999 . . . . 75.43 110.542 177.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -70.68 -43.57 68.8 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.823 -0.626 . . . . 60.15 110.515 176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -66.72 -39.58 88.05 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.495 0.554 . . . . 64.55 112.495 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.84 -31.87 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 C-N-CA 119.813 -0.755 . . . . 75.24 110.878 -178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -68.34 -45.39 73.0 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 121.163 0.506 . . . . 63.14 110.682 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -67.98 -39.78 83.23 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.839 -1.073 . . . . 72.02 110.339 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 50.2 m0 -69.24 -37.89 78.21 Favored 'General case' 0 C--O 1.208 -1.086 0 C-N-CA 120.705 -0.398 . . . . 64.33 110.689 178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 94.7 m -64.03 -32.73 74.39 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.73 0.3 . . . . 62.41 110.394 177.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -59.55 -51.69 68.75 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 109.786 -0.45 . . . . 70.55 109.786 172.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.95 -33.44 75.82 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.595 -0.73 . . . . 72.35 111.794 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -61.23 -50.03 74.71 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 116.17 -0.468 . . . . 62.31 110.194 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.7 m -65.38 -37.74 87.91 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.986 -0.552 . . . . 65.54 110.162 -177.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.84 -35.69 72.55 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.974 -0.557 . . . . 75.41 112.227 179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -71.73 -45.19 62.52 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 120.584 -0.446 . . . . 74.14 110.23 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.33 -39.67 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.393 -0.367 . . . . 62.24 111.407 -178.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -68.63 -37.45 79.73 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.355 -0.384 . . . . 54.44 111.299 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 28.1 ttt -72.98 -41.53 64.26 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.158 -0.473 . . . . 54.3 110.662 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 213' ' ' GLN . 3.7 ppp? -73.66 -30.89 63.18 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 120.306 -0.558 . . . . 71.13 111.458 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' A' ' 215' ' ' ILE . . . -74.06 -33.84 63.84 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-O 121.116 0.484 . . . . 75.32 109.704 177.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -66.83 -41.05 88.09 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.784 -0.644 . . . . 65.25 110.977 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' ' 210' ' ' MET . 5.4 pp0? -67.92 -14.44 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.466 0.543 . . . . 75.05 112.466 -177.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 165.52 -88.09 0.1 Allowed Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 119.42 -1.371 . . . . 64.53 113.45 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 211' ' ' ALA . 42.1 pt -90.53 159.38 2.83 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 112.377 0.51 . . . . 71.02 112.377 -173.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 8.2 p -98.57 134.94 40.82 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.563 -1.273 . . . . 74.44 107.563 174.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -133.67 103.43 0.5 Allowed Glycine 0 N--CA 1.438 -1.213 0 C-N-CA 119.616 -1.278 . . . . 43.1 114.138 -173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -150.37 99.39 2.77 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 106.505 -1.665 . . . . 63.13 106.505 174.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -79.93 129.34 34.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.079 0.77 . . . . 62.51 113.079 -174.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -88.23 124.32 7.13 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 114.716 -1.129 . . . . 52.03 110.827 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -135.59 168.94 18.32 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.264 -1.013 . . . . 60.35 108.264 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . 0.442 ' HE2' ' OD1' ' A' ' 223' ' ' ASP . 18.1 ptmt -95.07 -31.93 13.35 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.827 0.346 . . . . 60.44 110.107 176.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . 0.442 ' OD1' ' HE2' ' A' ' 222' ' ' LYS . 6.9 p-10 . . . . . 0 CA--C 1.502 -0.872 0 N-CA-C 108.335 -0.987 . . . . 63.34 108.335 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.798 -0.816 . . . . 73.35 108.798 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.8 m -77.99 151.8 33.41 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 116.278 -0.419 . . . . 71.22 109.985 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.33 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 110.998 -0.841 . . . . 64.23 110.998 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -104.49 104.53 16.98 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 108.196 -1.038 . . . . 75.22 108.196 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -99.97 115.76 30.45 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 115.904 -0.589 . . . . 61.5 109.909 -178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -140.72 54.51 0.64 Allowed Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 110.386 -1.085 . . . . 60.03 110.386 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 p -93.74 86.91 5.27 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 121.849 0.833 . . . . 72.42 110.525 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.2 m -97.17 102.57 14.38 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.054 -1.091 . . . . 44.33 108.054 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -85.78 77.98 9.64 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.502 1.144 . . . . 61.15 111.898 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -137.61 99.99 4.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 104.931 -2.248 . . . . 62.1 104.931 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -46.99 -52.67 14.17 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.411 1.634 . . . . 71.21 115.411 -170.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.7 mptt 70.28 80.7 0.17 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.506 0.67 . . . . 72.22 111.001 -169.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -138.28 122.77 18.43 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 108.381 -0.97 . . . . 73.33 108.381 174.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.62 -57.34 3.94 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.947 -0.57 . . . . 72.31 111.328 -173.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.2 m 38.16 68.53 0.31 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.465 1.506 . . . . 73.52 114.67 177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.3 t -100.52 114.76 40.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 108.846 -0.798 . . . . 74.33 108.846 176.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.8 p -90.5 145.73 7.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 109.409 -0.589 . . . . 73.11 109.409 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -145.0 148.3 33.59 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 108.637 -0.875 . . . . 75.41 108.637 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.9 56.56 0.48 Allowed Glycine 0 N--CA 1.442 -0.927 0 N-CA-C 109.457 -1.457 . . . . 41.22 109.457 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 123.35 27.35 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.134 -0.533 . . . . 61.22 112.008 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.0 t -173.49 132.39 0.47 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.19 -1.041 . . . . 63.24 108.19 176.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.6 m -85.29 107.22 17.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 109.25 -0.648 . . . . 71.4 109.25 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.1 t -76.74 99.66 2.21 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-O 120.99 0.424 . . . . 75.14 110.811 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 67.7 160.26 0.16 Allowed 'General case' 0 C--O 1.24 0.557 0 C-N-CA 125.349 1.459 . . . . 43.45 113.1 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -98.93 173.84 6.65 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 114.93 -1.032 . . . . 74.24 111.643 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.7 m -103.41 173.2 6.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 105.198 -2.149 . . . . 33.13 105.198 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.21 -35.93 81.96 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 118.659 0.663 . . . . 62.01 112.477 -176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' HE2' ' SG ' ' A' ' 86' ' ' CYS . 26.0 tptp -70.58 -45.11 66.0 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 120.135 -0.626 . . . . 73.42 109.66 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -66.19 -32.65 74.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 114.888 -1.051 . . . . 73.33 110.861 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.77 -40.0 76.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.133 -0.692 . . . . 60.32 109.133 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 82' ' ' LYS . 70.2 mt -59.76 -42.24 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.687 -0.688 . . . . 74.2 109.765 174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -60.89 -34.27 74.39 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 116.101 -0.5 . . . . 70.44 111.405 176.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -67.54 -43.7 80.09 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.486 -0.561 . . . . 73.42 109.486 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.11 -45.2 93.75 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.714 -0.847 . . . . 72.21 108.714 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -40.9 86.86 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.265 -0.88 . . . . 75.31 110.279 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -65.29 -36.61 84.6 Favored 'General case' 0 C--O 1.202 -1.413 0 C-N-CA 123.684 0.794 . . . . 70.3 110.048 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 37' ' ' ARG . 10.7 tpt180 -74.21 -33.03 63.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 119.91 -0.716 . . . . 73.43 110.891 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -73.45 -34.58 65.48 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.446 0.641 . . . . 73.42 109.965 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.483 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 34.4 t -92.13 24.61 3.23 Favored 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.162 0.985 . . . . 73.41 110.764 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 97' ' ' ALA . . . -121.14 125.53 47.45 Favored 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 108.601 -0.889 . . . . 64.53 108.601 174.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -118.51 139.99 50.58 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 120.663 -0.415 . . . . 73.44 110.813 178.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.93 70.4 1.6 Allowed 'General case' 0 N--CA 1.414 -2.263 0 CA-C-O 123.003 1.382 . . . . 73.22 110.509 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 m -63.88 -28.96 70.19 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 113.408 -1.723 . . . . 61.12 112.185 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -90.77 -3.02 57.75 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 121.864 -0.522 . . . . 73.25 111.781 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -114.46 99.9 7.91 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.146 -0.687 . . . . 74.53 109.146 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -74.91 117.75 17.1 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.85 -1.167 . . . . 73.4 107.85 176.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.757 HG21 ' HG3' ' A' ' 99' ' ' ARG . 71.1 p -69.73 107.14 3.35 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-N 115.68 -0.691 . . . . 73.24 111.019 -172.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.4 m -112.27 106.74 15.38 Favored 'General case' 0 N--CA 1.412 -2.346 0 CA-C-N 114.518 -1.219 . . . . 73.33 109.827 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 73.7 mmtt 65.81 40.62 4.19 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.812 1.245 . . . . 73.43 113.849 176.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 12.4 m95 -72.52 98.79 2.36 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.977 -0.749 . . . . 71.42 108.977 171.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.499 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 14.8 m120 -103.79 62.23 0.76 Allowed 'General case' 0 C--N 1.291 -1.947 0 CA-C-O 122.319 1.057 . . . . 55.12 108.801 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.48 -46.27 55.59 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 113.935 -1.484 . . . . 74.13 108.0 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -64.64 -29.07 70.07 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 113.653 -1.612 . . . . 71.35 110.56 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 5.3 tp10 -74.66 -43.27 56.13 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.359 -0.837 . . . . 73.11 110.06 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.9 tptt -69.7 -35.62 75.22 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.917 -0.583 . . . . 50.13 110.422 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.46 -20.47 13.25 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.218 0 C-N-CA 120.044 -0.662 . . . . 73.44 111.338 178.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 3.2 tmmm? -67.8 -34.92 77.71 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 106.787 -1.561 . . . . 72.33 106.787 174.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -76.36 -38.0 56.43 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 114.266 -1.333 . . . . 65.21 110.298 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -84.13 -26.25 29.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 114.824 1.416 . . . . 73.02 114.824 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.439 HD22 HD21 ' A' ' 195' ' ' ASN . 28.9 tp -148.56 27.46 0.9 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 120.18 -0.608 . . . . 53.34 112.482 -173.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 11.0 m120 67.05 -171.47 0.19 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.338 0.655 . . . . 71.51 111.273 176.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -58.92 -22.12 59.14 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.8 0.84 . . . . 74.44 112.644 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.44 -20.39 64.64 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 116.136 -0.484 . . . . 45.44 111.493 -171.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . . . -97.56 -2.46 41.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 112.071 0.397 . . . . 64.44 112.071 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.7 t -61.38 129.02 23.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 CA-C-O 121.554 0.692 . . . . 62.12 110.797 -179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 21.62 35.2 Favored Glycine 0 C--O 1.203 -1.822 0 CA-C-N 114.652 -1.158 . . . . 65.41 110.868 -177.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.428 ' O ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.45 -40.73 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.901 1.28 . . . . 43.13 111.522 -178.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 4.9 pt-20 -62.38 -44.99 95.15 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 123.075 0.55 . . . . 74.54 110.899 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.7 m -73.65 -34.66 65.05 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.388 0.613 . . . . 75.34 109.601 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tpp85 -63.63 -46.22 86.66 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.016 -0.993 . . . . 64.45 108.631 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 67' ' ' ILE . 70.7 mt -63.1 -40.17 96.84 Favored 'General case' 0 C--O 1.202 -1.408 0 CA-C-N 116.06 -0.518 . . . . 70.21 110.335 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 68' ' ' GLU . 86.0 mt -63.57 -45.69 89.29 Favored 'General case' 0 C--N 1.311 -1.097 0 O-C-N 123.469 0.481 . . . . 43.15 111.097 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 76' ' ' LYS . . . -70.07 -37.81 75.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 116.325 -0.398 . . . . 55.24 111.177 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.6 mt -76.96 -33.65 21.03 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 116.325 -0.398 . . . . 52.22 110.815 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.95 -37.28 81.39 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 108.58 -0.896 . . . . 55.11 108.58 175.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 28.0 ttpp -54.87 -46.25 74.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.345 -0.843 . . . . 73.23 110.349 170.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.9 -38.27 90.49 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.952 -0.567 . . . . 73.52 112.013 177.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.418 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 38.7 m-85 -68.54 -38.05 80.48 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 120.885 0.374 . . . . 74.3 110.255 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -63.95 -43.46 95.78 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 115.557 -0.747 . . . . 74.02 109.8 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -66.46 -42.77 87.06 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.42 -0.585 . . . . 74.31 109.42 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 40.7 tp -71.53 -33.35 69.1 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.611 0.719 . . . . 71.15 110.944 -177.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HZ1' ' CD ' ' A' ' 118' ' ' GLU . 4.3 mptp? -84.94 -21.45 29.61 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 112.983 0.735 . . . . 72.41 112.983 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.2 p -75.71 -26.47 57.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 118.304 0.502 . . . . 70.3 111.452 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 13.5 p -82.72 -21.02 9.44 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 108.399 -0.963 . . . . 62.1 108.399 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 46.1 tp -77.88 -51.17 10.87 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.818 -1.083 . . . . 71.42 109.378 177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 28' ' ' LYS . 36.1 m -84.17 154.95 22.79 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 115.303 -0.862 . . . . 74.2 110.448 -177.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' A' ' 165' ' ' ASN . 12.1 t -89.74 136.02 33.28 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 122.027 -0.42 . . . . 45.14 110.566 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 75.96 12.76 83.74 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 115.917 -0.583 . . . . 45.23 113.735 174.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.63 119.67 53.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 N-CA-C 108.103 -1.073 . . . . 71.05 108.103 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -86.61 160.32 18.95 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.979 -0.378 . . . . 71.35 109.979 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -94.11 5.71 50.87 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.661 -0.699 . . . . 50.1 110.449 -176.124 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.6 t -118.97 100.95 50.56 Favored Pre-proline 0 C--N 1.294 -1.841 0 CA-C-O 121.455 0.645 . . . . 64.54 110.931 -178.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -88.21 151.88 6.81 Favored 'Trans proline' 0 N--CA 1.443 -1.48 0 C-N-CA 122.839 2.359 . . . . 60.12 111.035 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.91 -36.74 10.47 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 109.334 -0.617 . . . . 54.04 109.334 -176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.483 ' O ' ' HA ' ' A' ' 39' ' ' SER . 37.2 m80 -98.78 100.34 11.53 Favored 'General case' 0 C--O 1.202 -1.396 0 N-CA-C 108.418 -0.956 . . . . 72.12 108.418 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 95.5 t -120.36 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.199 0 N-CA-C 108.339 -0.986 . . . . 75.14 108.339 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 40' ' ' ALA . . . -75.55 162.43 28.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.987 0.422 . . . . 61.12 111.052 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -114.94 -7.82 12.55 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.674 0.75 . . . . 65.03 109.634 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HG3' HG21 ' A' ' 47' ' ' THR . 30.2 mmt180 -138.56 145.05 40.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 61.42 110.431 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.7 t -121.75 121.79 65.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.464 -0.939 . . . . 71.31 108.464 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.83 153.11 94.97 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 123.073 0.549 . . . . 64.04 112.427 -178.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -49.4 -49.43 15.62 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 124.14 3.227 . . . . 52.22 115.772 -174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -69.38 -37.58 79.76 Favored Glycine 0 C--N 1.304 -1.248 0 N-CA-C 111.212 -0.755 . . . . 61.22 111.212 -177.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 108' ' ' MET . 13.1 m-20 -64.95 -41.79 95.17 Favored 'General case' 0 CA--C 1.49 -1.343 0 CA-C-N 114.935 -0.632 . . . . 74.22 109.654 176.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.07 -44.78 87.7 Favored 'General case' 0 C--O 1.218 -0.559 0 O-C-N 123.717 0.635 . . . . 54.01 110.75 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 71.0 mt -60.41 -42.82 92.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 109.846 -0.427 . . . . 72.53 109.846 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 111' ' ' VAL . 52.5 m -65.43 -43.2 91.23 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.906 -0.588 . . . . 70.13 110.3 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.602 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 90.9 mmm -57.65 -46.15 84.57 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.111 0.565 . . . . 71.44 110.801 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.401 ' HG ' ' HG3' ' A' ' 192' ' ' MET . 11.0 mp -64.26 -37.95 89.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.718 0.294 . . . . 71.1 111.631 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -72.09 -40.4 68.26 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.532 -0.467 . . . . 74.53 111.469 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 107' ' ' SER . 97.5 t -68.13 -33.32 60.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.593 -0.276 . . . . 60.04 111.342 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 108' ' ' MET . 79.7 mt -62.19 -37.42 85.24 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.966 0.412 . . . . 64.14 110.58 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.7 t -66.53 -42.06 87.82 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.18 -0.674 . . . . 70.42 109.18 177.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 75.3 mt -66.7 -41.21 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 115.77 -0.65 . . . . 75.42 111.461 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.487 ' HA ' ' HG3' ' A' ' 118' ' ' GLU . 8.1 p -73.56 -34.43 65.15 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.593 0.711 . . . . 63.13 111.36 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -72.75 -25.65 61.27 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.712 -1.218 . . . . 72.14 107.712 177.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -71.13 -43.08 68.32 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.622 -0.717 . . . . 63.03 110.336 177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HG3' ' HA ' ' A' ' 115' ' ' THR 0.309 2.3 pp20? -68.46 -34.69 76.4 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.412 -0.915 . . . . 71.41 112.129 177.671 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.78 -43.94 87.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.908 0.385 . . . . 74.31 111.431 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 22.8 p -70.64 -35.34 72.86 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.531 -0.304 . . . . 74.54 111.063 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 t -68.01 -39.7 83.12 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.016 -0.735 . . . . 64.14 109.016 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.614 ' HG ' ' CZ3' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -59.94 -50.95 71.74 Favored 'General case' 0 C--O 1.207 -1.161 0 N-CA-C 107.462 -1.311 . . . . 71.35 107.462 177.385 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -59.62 -39.42 84.24 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.603 0.594 . . . . 63.45 112.603 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.94 -37.67 67.07 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.385 -0.37 . . . . 43.12 110.708 -178.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.484 ' HD3' ' CD1' ' A' ' 153' ' ' TRP . 28.4 mtpp -76.61 -31.83 57.69 Favored 'General case' 0 N--CA 1.428 -1.543 0 C-N-CA 119.812 -0.755 . . . . 73.04 111.191 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 122' ' ' LEU . 44.8 mt -56.19 -47.89 80.1 Favored 'Isoleucine or valine' 0 C--O 1.191 -2.003 0 N-CA-C 108.456 -0.942 . . . . 63.31 108.456 172.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -57.52 -35.61 70.49 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.584 -0.735 . . . . 74.31 112.128 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.428 ' O ' HG23 ' A' ' 132' ' ' VAL . 43.3 tt0 -69.85 -53.99 15.57 Favored 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 120.621 -0.432 . . . . 70.14 111.155 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.473 ' HB2' HG13 ' A' ' 142' ' ' ILE 0.4 1.0 OUTLIER -81.32 -19.3 43.17 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 115.399 1.629 . . . . 73.33 115.399 -174.906 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -77.8 -18.69 56.1 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.787 -0.819 . . . . 63.22 108.787 178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -90.44 -13.14 35.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.362 -0.835 . . . . 71.2 109.087 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 128' ' ' GLU . 73.0 t -72.59 144.36 13.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 108.354 -0.98 . . . . 62.23 108.354 174.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -107.42 -167.96 1.33 Allowed 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 116.623 -0.262 . . . . 73.21 110.498 -175.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.56 109.23 0.66 Allowed 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 107.699 -1.223 . . . . 71.12 107.699 173.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.2 m -97.54 150.8 20.7 Favored 'General case' 0 C--N 1.28 -2.437 0 CA-C-N 115.588 -0.733 . . . . 62.43 110.582 -173.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -70.33 1.15 5.25 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 124.587 1.155 . . . . 75.4 111.631 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -79.24 -14.5 59.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.094 -0.957 . . . . 75.41 108.807 176.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 102.06 3.12 51.69 Favored Glycine 0 CA--C 1.492 -1.401 0 N-CA-C 110.16 -1.176 . . . . 74.01 110.16 -175.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 7.2 m -86.68 138.92 31.26 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 113.9 -1.15 . . . . 74.02 108.576 -178.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.464 ' HD2' ' N ' ' A' ' 140' ' ' LYS . 11.4 mptt -94.99 -178.0 4.34 Favored 'General case' 0 C--N 1.287 -2.11 0 N-CA-C 107.332 -1.359 . . . . 75.52 107.332 178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.06 140.32 18.28 Favored 'Isoleucine or valine' 0 C--O 1.251 1.162 0 N-CA-C 108.586 -0.894 . . . . 74.45 108.586 175.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 129' ' ' TRP . 34.8 mm -78.43 91.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-O 122.825 1.298 . . . . 74.3 108.903 -178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -104.41 -26.35 12.46 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 113.343 -1.753 . . . . 65.34 110.911 -174.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -118.62 162.3 18.63 Favored 'General case' 0 C--N 1.309 -1.182 0 O-C-N 122.201 -0.312 . . . . 65.01 110.504 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.467 HD12 HD22 ' A' ' 172' ' ' LEU . 5.0 tt -81.8 -9.09 11.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 C-N-CA 123.394 0.678 . . . . 62.14 111.495 -176.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.612 ' O ' ' HD2' ' A' ' 146' ' ' LYS . 0.0 OUTLIER -111.29 33.68 4.53 Favored 'General case' 0 N--CA 1.423 -1.8 0 CA-C-O 122.53 1.157 . . . . 75.22 109.576 -169.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -86.07 154.92 21.05 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.228 -0.896 . . . . 71.03 108.954 175.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -52.65 -37.62 58.92 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 123.828 0.851 . . . . 73.11 111.57 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -73.69 -35.73 65.19 Favored 'General case' 0 CA--C 1.512 -0.507 0 O-C-N 122.341 -0.224 . . . . 64.05 111.19 -178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.426 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 17.9 p -75.95 -39.05 56.88 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 119.735 -0.786 . . . . 74.24 109.626 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.12 -30.45 70.38 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.318 0.647 . . . . 70.54 110.026 177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 92.3 m -64.02 -39.02 93.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.523 -0.308 . . . . 65.34 110.697 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.614 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 90.8 t90 -76.5 -41.85 45.51 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.023 0.44 . . . . 75.21 110.441 177.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 39.9 m-85 -63.19 -48.0 80.18 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.624 -0.716 . . . . 73.24 112.202 -177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 89.9 t -69.16 -27.18 33.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 C-N-CA 120.939 -0.304 . . . . 72.43 110.773 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.058 -0.719 . . . . 62.4 109.058 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -74.1 -7.51 52.81 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 114.459 -1.246 . . . . 74.12 113.49 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 104.67 -2.27 42.17 Favored Glycine 0 N--CA 1.435 -1.428 0 C-N-CA 119.797 -1.192 . . . . 43.34 113.209 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.481 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 77.0 m-85 -76.59 105.34 7.6 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.401 -1.333 . . . . 74.42 107.401 178.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.619 ' HB2' ' HG2' ' A' ' 163' ' ' GLU . 49.3 mttp -67.13 158.64 30.71 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.019 -1.104 . . . . 73.33 108.019 178.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 55.3 t -63.52 -26.52 40.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 CA-C-O 121.391 0.615 . . . . 70.35 110.133 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.3 -5.31 59.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.916 -0.584 . . . . 74.04 111.88 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.619 ' HG2' ' HB2' ' A' ' 160' ' ' LYS . 10.4 mm-40 -83.6 -39.64 20.07 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.999 -0.28 . . . . 63.23 111.09 -179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 164' ' ' LEU . 2.5 pt? -91.17 155.01 18.92 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 119.812 -0.755 . . . . 74.23 111.751 -175.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' A' ' 87' ' ' THR . 9.6 p30 -106.32 162.87 13.3 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.201 -1.037 . . . . 73.32 108.201 175.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.42 89.76 5.6 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.535 0.683 . . . . 74.21 111.767 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.6 t -103.5 160.99 4.45 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.035 -1.098 . . . . 75.15 108.035 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 21.6 p -81.02 143.97 32.11 Favored 'General case' 0 N--CA 1.419 -1.982 0 N-CA-C 108.432 -0.951 . . . . 63.32 108.432 172.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 23.1 tp -74.12 -28.21 61.24 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.058 0.456 . . . . 72.35 109.851 -173.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.12 -35.79 59.12 Favored 'General case' 0 N--CA 1.428 -1.573 0 C-N-CA 119.801 -0.76 . . . . 73.01 110.135 -179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -68.34 -44.02 76.2 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.871 -0.732 . . . . 74.14 109.123 176.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . 0.467 HD22 HD12 ' A' ' 145' ' ' ILE . 35.0 tp -56.79 -47.9 79.15 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.568 -0.742 . . . . 74.54 110.448 177.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.5 -32.76 74.31 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.989 -0.551 . . . . 72.25 112.121 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 47.1 m -74.11 -39.92 63.05 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 123.76 0.663 . . . . 72.42 110.818 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.31 -35.4 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 C-N-CA 119.196 -1.002 . . . . 74.01 110.636 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 172' ' ' LEU . 95.6 t -66.68 -44.13 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.351 -0.386 . . . . 65.25 110.906 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.13 -32.63 73.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 C-N-CA 119.71 -0.796 . . . . 63.43 111.425 -175.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.66 -31.1 52.44 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 119.589 -0.844 . . . . 63.43 111.564 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.05 -48.81 64.6 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.142 -0.688 . . . . 74.21 109.142 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 31.8 m -74.84 -15.47 16.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 112.371 0.508 . . . . 52.4 112.371 -176.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.9 m -110.15 20.19 18.14 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 113.996 1.11 . . . . 74.54 113.996 -177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -78.49 151.2 32.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 116.855 -1.938 . . . . 73.42 109.081 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.56 -33.24 69.72 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 114.91 1.448 . . . . 61.43 114.91 -170.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.453 ' O ' HG12 ' A' ' 188' ' ' ILE . 35.0 t70 -76.5 -37.6 56.55 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.737 -0.785 . . . . 62.21 110.314 178.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 16.0 tpt -66.44 -37.89 86.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.466 -0.788 . . . . 71.35 110.613 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 79.5 mt -62.43 -42.73 96.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.28 -0.418 . . . . 74.23 110.557 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -73.14 -39.54 65.61 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 118.786 -1.166 . . . . 73.45 109.906 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 184' ' ' ASP . 36.7 mm -62.59 -41.21 91.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 O-C-N 123.072 0.232 . . . . 52.4 110.942 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -59.59 -47.73 84.42 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.66 0.267 . . . . 63.02 110.512 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.77 -34.69 77.3 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.294 0.569 . . . . 72.34 110.805 -178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -65.45 -44.94 85.69 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 115.855 -0.611 . . . . 73.13 109.81 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.401 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 0.0 OUTLIER -63.11 -41.5 99.36 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.395 -0.366 . . . . 72.22 111.286 177.352 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -63.37 -37.9 89.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.15 0.5 . . . . 53.35 110.869 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.6 -42.19 71.32 Favored 'General case' 0 C--O 1.208 -1.122 0 CA-C-N 116.303 -0.408 . . . . 54.35 110.13 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.439 HD21 HD22 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -64.11 -42.66 96.78 Favored 'General case' 0 CA--C 1.494 -1.183 0 N-CA-C 112.478 0.548 . . . . 74.11 112.478 -179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.94 -37.36 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 C-N-CA 120.023 -0.671 . . . . 64.32 110.735 -178.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -73.58 -36.84 65.62 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 121.266 0.555 . . . . 74.31 109.669 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -62.78 -46.99 85.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.186 -0.916 . . . . 61.05 109.812 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . 0.45 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 53.5 m0 -71.95 -29.56 64.4 Favored 'General case' 0 C--O 1.207 -1.18 0 C-N-CA 120.496 -0.482 . . . . 64.22 111.305 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 98.0 m -64.55 -39.17 93.27 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 109.081 -0.711 . . . . 72.44 109.081 173.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -59.95 -46.17 90.27 Favored 'General case' 0 C--O 1.242 0.668 0 N-CA-C 109.0 -0.741 . . . . 71.41 109.0 175.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -60.14 -43.95 95.31 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.183 -0.917 . . . . 65.23 110.28 177.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 53.3 mt-10 -62.03 -39.7 93.22 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.792 0.437 . . . . 75.24 110.796 179.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 20.5 m -65.09 -44.72 87.93 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.799 -0.637 . . . . 50.14 110.842 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.82 -33.39 64.15 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 119.763 -0.775 . . . . 65.15 110.233 -178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -66.91 -42.83 84.77 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.464 -0.789 . . . . 73.45 110.104 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 54.8 tp -69.76 -39.21 76.83 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.835 -0.431 . . . . 63.14 109.835 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.31 -43.47 94.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.447 0.641 . . . . 64.34 109.994 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 44.6 ttm -63.69 -41.46 98.13 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.372 -0.831 . . . . 61.51 110.015 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 215' ' ' ILE . 43.5 ttm -64.9 -44.19 90.39 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.194 -0.912 . . . . 72.02 109.987 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -65.62 -40.98 93.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.614 -0.721 . . . . 74.31 110.654 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -68.21 -24.54 64.95 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.644 0.735 . . . . 73.25 110.494 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -88.81 -8.06 55.04 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 115.409 -0.814 . . . . 75.25 110.084 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 74.93 33.76 54.39 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 116.009 -0.541 . . . . 74.42 111.871 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' ' 210' ' ' MET . 49.7 mm -120.86 151.89 23.91 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 N-CA-C 107.353 -1.351 . . . . 64.4 107.353 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 49.3 m -152.56 122.95 7.21 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.898 -0.408 . . . . 74.22 109.898 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 125.86 88.24 0.7 Allowed Glycine 0 N--CA 1.439 -1.108 0 C-N-CA 119.741 -1.219 . . . . 73.04 114.597 175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -129.92 91.66 3.17 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.497 -1.297 . . . . 51.22 107.497 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -79.49 129.92 34.92 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.586 0.708 . . . . 72.31 112.424 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -162.23 176.12 38.64 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 105.998 -2.841 . . . . 70.34 105.998 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -110.51 93.13 4.33 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 119.323 1.562 . . . . 65.44 109.982 177.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -113.33 7.41 17.68 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.321 -1.309 . . . . 73.34 108.278 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 105.767 -1.938 . . . . 74.03 105.767 -179.091 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.447 -0.605 0 N-CA-C 110.36 -0.237 . . . . 74.43 110.36 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 m 63.74 -174.5 0.16 Allowed 'General case' 0 C--O 1.249 1.052 0 C-N-CA 123.889 0.876 . . . . 65.3 112.878 178.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -177.8 176.49 48.05 Favored Glycine 0 N--CA 1.425 -2.044 0 N-CA-C 107.227 -2.349 . . . . 73.55 107.227 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.7 tp -83.79 90.71 2.59 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 CA-C-N 118.147 0.973 . . . . 65.0 110.529 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -98.3 85.67 3.48 Favored 'General case' 0 N--CA 1.417 -2.113 0 N-CA-C 108.381 -0.97 . . . . 74.43 108.381 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.43 28.67 10.4 Favored Glycine 0 C--N 1.309 -0.961 0 N-CA-C 111.119 -0.792 . . . . 45.41 111.119 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.6 p -95.59 118.73 32.83 Favored 'General case' 0 N--CA 1.424 -1.757 0 C-N-CA 123.274 0.63 . . . . 62.4 110.003 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.6 t -156.19 127.62 7.16 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.181 0.515 . . . . 74.51 110.348 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -157.89 96.66 1.5 Allowed 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.035 -1.469 . . . . 65.32 107.035 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.06 145.68 41.22 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.645 0.609 . . . . 75.55 112.645 -177.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -60.7 -29.38 69.3 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 124.605 1.162 . . . . 63.41 111.842 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 61.16 67.67 0.78 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.085 0.954 . . . . 74.22 109.754 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -89.16 92.03 9.03 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.935 0.874 . . . . 73.31 112.309 -176.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.5 -31.04 24.7 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.54 -0.911 . . . . 73.14 108.54 175.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.9 m 56.75 98.76 0.02 OUTLIER 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.206 1.403 . . . . 73.12 113.852 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.17 98.64 0.57 Allowed 'Isoleucine or valine' 0 C--O 1.247 0.956 0 CA-C-O 122.378 1.085 . . . . 71.41 110.959 176.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.7 p -83.55 110.9 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.328 0 CA-C-N 114.552 -1.204 . . . . 64.4 110.608 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -128.88 104.85 7.84 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 108.302 -0.999 . . . . 74.55 108.302 179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.35 91.2 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 CA-C-N 115.733 -0.667 . . . . 74.21 112.482 -177.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -144.72 119.05 9.56 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.19 -1.041 . . . . 75.33 108.19 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -139.91 111.81 7.46 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 120.66 -0.416 . . . . 53.54 109.931 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.9 m -88.76 111.23 21.75 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 108.366 -0.975 . . . . 70.1 108.366 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.2 m -81.33 99.94 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 CA-C-O 121.691 0.758 . . . . 72.43 109.861 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 69.82 169.01 0.3 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 113.925 -1.489 . . . . 73.53 110.731 -173.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.79 178.31 6.08 Favored 'General case' 0 C--N 1.276 -2.63 0 CA-C-N 115.058 -0.974 . . . . 65.54 108.71 176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 m -61.05 177.11 0.36 Allowed 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 123.564 0.746 . . . . 64.25 112.142 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' ND1' ' A' ' 157' ' ' HIS . 23.8 mt -61.28 -20.67 63.16 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 114.03 1.122 . . . . 71.53 114.03 -168.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.0 tptt -72.15 -46.37 56.77 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 118.96 -1.096 . . . . 71.41 108.988 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -70.83 -32.08 69.01 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.318 -0.855 . . . . 74.03 110.337 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -60.8 -50.58 72.87 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 108.346 -0.983 . . . . 72.2 108.346 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.432 HG23 ' CZ ' ' A' ' 78' ' ' PHE . 55.4 mt -68.38 -30.09 46.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.129 -1.396 . . . . 74.52 110.863 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.47 ' HA ' ' NZ ' ' A' ' 82' ' ' LYS . 21.2 m-20 -75.29 -36.65 61.13 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.387 -0.369 . . . . 41.35 111.795 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -65.73 -45.92 80.84 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 122.707 0.403 . . . . 71.23 110.329 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 tp -67.11 -37.98 84.84 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.412 0.625 . . . . 55.21 110.535 -177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.58 -40.72 66.39 Favored 'General case' 0 N--CA 1.421 -1.887 0 CA-C-N 115.277 -0.874 . . . . 33.03 110.661 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -69.35 -28.25 66.06 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 123.242 0.338 . . . . 61.21 110.758 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -66.54 -40.02 88.88 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.173 -0.676 . . . . 73.32 109.173 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' OH ' ' HG2' ' A' ' 76' ' ' LYS . 3.9 t80 -72.2 -36.67 69.26 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.955 -0.566 . . . . 71.13 111.554 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.2 m -84.75 24.46 1.03 Allowed 'General case' 0 C--O 1.254 1.307 0 C-N-CA 124.629 1.172 . . . . 71.34 111.282 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -129.52 140.25 51.3 Favored 'General case' 0 N--CA 1.412 -2.37 0 N-CA-C 106.934 -1.506 . . . . 71.43 106.934 176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -117.08 141.43 48.27 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 109.215 -0.661 . . . . 73.42 109.215 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.502 HD11 ' HB2' ' A' ' 99' ' ' ARG . 2.2 pp -120.98 40.45 3.55 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.197 0.522 . . . . 73.44 112.37 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.09 -24.68 68.02 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-O 121.702 0.763 . . . . 63.24 111.679 176.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -72.18 -8.29 53.94 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.349 -0.841 . . . . 75.52 110.449 177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -100.26 126.6 46.59 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.94 -0.763 . . . . 75.21 108.94 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.96 110.34 9.17 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 108.249 -1.019 . . . . 71.31 108.249 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.578 HG21 ' HG3' ' A' ' 99' ' ' ARG . 44.9 p -96.18 82.11 3.42 Favored 'General case' 0 N--CA 1.423 -1.818 0 C-N-CA 120.338 -0.545 . . . . 54.01 111.503 -174.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.0 m -80.46 87.07 5.7 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 115.868 -0.606 . . . . 63.41 110.565 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt 36.67 76.97 0.05 OUTLIER 'General case' 0 C--O 1.245 0.84 0 C-N-CA 126.687 1.995 . . . . 62.24 114.184 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.527 ' CE3' ' HB3' ' A' ' 99' ' ' ARG . 44.3 m0 -65.92 116.55 7.18 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.949 -1.13 . . . . 73.22 107.949 175.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -88.71 60.86 5.76 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-O 122.731 1.253 . . . . 74.25 108.026 -172.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -82.99 -41.35 18.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.379 -1.737 . . . . 75.44 109.245 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -60.22 -34.0 73.05 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 114.999 -1.0 . . . . 74.12 109.98 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -69.09 -44.84 71.69 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.943 -1.026 . . . . 75.11 109.982 -178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -69.48 -37.57 77.31 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.934 -0.575 . . . . 65.41 111.506 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.447 HG11 HG12 ' A' ' 67' ' ' ILE . 34.6 m -76.35 -29.81 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.619 0 C-N-CA 119.377 -0.929 . . . . 73.42 112.28 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -72.22 -19.1 61.78 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 119.368 -0.933 . . . . 73.23 110.327 176.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -85.2 -46.95 10.58 Favored 'General case' 0 N--CA 1.413 -2.277 0 CA-C-O 121.512 0.672 . . . . 73.2 109.793 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.09 -28.56 23.98 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.521 -0.763 . . . . 74.41 112.364 -174.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.92 -0.14 10.15 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-O 121.011 0.434 . . . . 71.41 110.169 -174.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.456 ' N ' HD22 ' A' ' 61' ' ' ASN . 0.8 OUTLIER 76.7 175.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.885 0.874 . . . . 74.51 111.877 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.09 -18.28 60.25 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.422 0.689 . . . . 75.24 112.247 -173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HB3' ' OH ' ' A' ' 187' ' ' TYR . 63.5 mttm -67.51 -2.06 5.92 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.975 0.732 . . . . 74.03 112.975 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 12.98 30.23 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 122.81 0.444 . . . . 52.21 110.631 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.97 122.75 2.76 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 C-N-CA 124.487 1.115 . . . . 62.14 113.257 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 70' ' ' ARG . . . 81.03 51.98 4.51 Favored Glycine 0 CA--C 1.492 -1.382 0 N-CA-C 109.795 -1.322 . . . . 63.24 109.795 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.447 HG12 HG11 ' A' ' 56' ' ' VAL . 8.0 tp -70.4 -53.99 20.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 N-CA-C 112.774 0.657 . . . . 74.22 112.774 -172.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -62.3 -41.65 98.69 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.534 0.207 . . . . 73.34 110.833 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.9 t -67.22 -34.96 78.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.189 -0.46 . . . . 60.35 110.001 -178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 66' ' ' GLY . 2.3 tpp180 -67.9 -44.44 76.97 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.196 -0.668 . . . . 73.5 109.196 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' HG ' ' SD ' ' A' ' 108' ' ' MET . 7.4 mp -61.24 -40.99 96.09 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.486 -0.779 . . . . 53.31 112.136 -178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 97' ' ' ALA . 2.5 mm? -74.74 -33.65 62.39 Favored 'General case' 0 C--O 1.212 -0.884 0 C-N-CA 118.583 -1.247 . . . . 74.42 111.043 177.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.25 87.8 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.006 0.431 . . . . 74.32 111.67 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.48 -39.21 61.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 116.334 -0.393 . . . . 71.34 110.238 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.26 81.75 Favored 'General case' 0 C--O 1.199 -1.589 0 N-CA-C 109.94 -0.393 . . . . 65.11 109.94 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tmtm? -54.88 -50.8 67.85 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.207 1.403 . . . . 62.21 109.126 172.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' CD ' ' HD3' ' A' ' 80' ' ' LYS . 19.8 tp10 -70.19 -26.96 64.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.287 -0.87 . . . . 71.44 110.15 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.432 ' CZ ' HG23 ' A' ' 31' ' ' ILE . 65.6 t80 -81.71 -28.17 33.55 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.737 -0.665 . . . . 75.52 110.154 176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 27.0 t-80 -71.59 -43.22 66.66 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 115.959 -0.564 . . . . 65.53 109.784 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.427 ' HD3' ' CD ' ' A' ' 77' ' ' GLU . 21.8 ptmt -66.06 -26.06 67.32 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.228 0.537 . . . . 73.41 109.955 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.559 ' O ' HG22 ' A' ' 84' ' ' VAL . 30.0 tp -69.41 -57.61 5.04 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.982 -0.554 . . . . 70.13 110.191 172.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' HA ' ' A' ' 32' ' ' ASP . 21.1 ptmt -71.88 -21.95 61.58 Favored 'General case' 0 C--O 1.204 -1.311 0 N-CA-C 113.917 1.08 . . . . 61.0 113.917 -173.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.8 p -68.36 -22.26 64.68 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 118.46 0.573 . . . . 73.22 112.11 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 81' ' ' LEU . 11.3 m -86.58 -20.24 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.327 0 N-CA-C 109.286 -0.635 . . . . 44.22 109.286 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -95.91 -22.47 17.41 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 115.593 -0.731 . . . . 73.41 111.951 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.8 m -114.98 128.39 56.25 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.756 -0.831 . . . . 74.03 108.756 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.573 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 12.4 t -86.03 141.35 29.53 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 120.279 -0.568 . . . . 62.03 110.808 -174.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 94.34 3.0 63.45 Favored Glycine 0 N--CA 1.427 -1.905 0 N-CA-C 110.931 -0.868 . . . . 71.23 110.931 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.32 127.45 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.006 0.431 . . . . 72.3 110.18 -177.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -79.18 133.87 36.7 Favored 'General case' 0 C--O 1.209 -1.065 0 N-CA-C 107.274 -1.38 . . . . 75.42 107.274 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -71.87 -6.44 41.74 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.348 0.499 . . . . 73.33 112.348 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 p -141.65 94.38 7.41 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 123.152 0.581 . . . . 71.45 110.955 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -76.22 161.78 34.77 Favored 'Trans proline' 0 C--O 1.244 0.776 0 C-N-CA 121.913 1.742 . . . . 43.14 111.945 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.73 -23.95 16.74 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 122.245 1.022 . . . . 75.02 108.642 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -98.49 97.6 8.9 Favored 'General case' 0 N--CA 1.417 -2.123 0 CA-C-N 114.702 -1.136 . . . . 74.32 108.013 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 63.0 t -121.6 124.16 71.07 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.822 0 N-CA-C 107.79 -1.189 . . . . 73.4 107.79 175.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . . . -71.41 152.73 42.85 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.345 0.593 . . . . 63.33 111.309 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -116.44 -21.35 9.28 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.888 -0.596 . . . . 75.45 110.697 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.578 ' HG3' HG21 ' A' ' 47' ' ' THR . 38.2 mmt180 -118.97 137.14 53.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.565 -0.288 . . . . 62.22 111.727 -174.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.9 t -122.78 119.51 58.18 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 109.022 -0.733 . . . . 74.24 109.022 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m -73.21 152.07 90.26 Favored Pre-proline 0 C--N 1.306 -1.283 0 CA-C-N 116.342 -0.39 . . . . 61.24 110.157 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -50.53 -45.41 34.87 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.255 2.637 . . . . 52.25 112.911 177.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.53 -43.22 96.9 Favored Glycine 0 C--N 1.313 -0.726 0 CA-C-N 115.792 -0.64 . . . . 54.11 111.541 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -39.19 88.71 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.978 0.911 . . . . 72.04 110.479 178.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -61.71 -40.72 96.04 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.282 -0.872 . . . . 64.41 111.083 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -61.83 -41.24 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 CA-C-O 121.005 0.431 . . . . 62.22 109.93 -178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 16.5 m -68.58 -43.3 76.81 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.632 -0.713 . . . . 71.13 110.11 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.567 ' SD ' ' HG ' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -63.84 -42.3 97.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.929 -0.578 . . . . 74.34 109.555 -177.628 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 105' ' ' ALA . 9.6 mp -64.66 -35.61 81.58 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 116.465 -0.334 . . . . 62.14 111.85 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -75.13 -34.01 61.62 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.674 0.62 . . . . 70.11 112.674 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' SER . 92.9 t -70.97 -44.8 75.37 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 C-N-CA 120.715 -0.394 . . . . 61.21 110.045 176.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.61 -42.37 78.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.088 0.471 . . . . 73.43 110.31 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 p -71.45 -28.02 63.67 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 113.005 0.743 . . . . 71.12 113.005 -177.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 13.9 tt -85.09 -37.28 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.95 0 C-N-CA 119.822 -0.751 . . . . 75.35 109.842 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.467 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 85.2 m -64.02 -37.06 86.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.41 -0.359 . . . . 42.1 111.906 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -68.01 -33.11 73.98 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.519 -0.872 . . . . 72.22 109.855 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -69.31 -41.52 76.62 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 116.14 -0.482 . . . . 73.33 109.949 -178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.423 ' CG ' ' HA ' ' A' ' 115' ' ' THR . 4.7 pt-20 -70.14 -36.69 74.93 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-O 119.492 -0.289 . . . . 61.12 111.316 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 115' ' ' THR . 86.5 mt -63.98 -40.46 96.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 120.838 0.351 . . . . 61.24 110.275 176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 24.3 t -65.56 -43.3 90.29 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.842 -0.617 . . . . 71.21 109.498 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 37.1 m -69.03 -34.87 75.91 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.197 0.523 . . . . 72.45 110.654 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.459 ' O ' HG12 ' A' ' 126' ' ' ILE . 5.6 tt -62.08 -52.61 63.23 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 108.372 -0.974 . . . . 64.44 108.372 175.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.454 ' HE3' ' OD1' ' A' ' 177' ' ' ASN . 12.5 tmtt? -58.12 -41.61 84.01 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.315 -0.857 . . . . 73.22 109.498 -177.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -59.14 -44.05 92.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.724 -0.671 . . . . 73.11 112.438 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.41 ' HB3' ' CH2' ' A' ' 129' ' ' TRP . 62.7 mttp -79.26 -38.54 35.23 Favored 'General case' 0 N--CA 1.428 -1.566 0 C-N-CA 119.501 -0.88 . . . . 74.3 111.612 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.582 HD13 ' HE1' ' A' ' 129' ' ' TRP . 28.8 mm -61.09 -45.52 98.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 C-N-CA 123.34 0.656 . . . . 65.12 110.674 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.37 -20.58 57.04 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.712 -0.676 . . . . 71.12 110.469 -175.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.55 -48.56 12.56 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.798 -0.637 . . . . 74.15 110.486 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.582 ' HE1' HD13 ' A' ' 126' ' ' ILE 0.447 1.3 p90 -70.8 -18.34 62.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 114.321 1.23 . . . . 74.42 114.321 179.045 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -56.6 -36.53 69.5 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.447 -0.946 . . . . 71.44 108.447 170.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -84.09 -15.93 45.57 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.696 -1.138 . . . . 75.31 112.705 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.422 HG23 ' HA ' ' A' ' 129' ' ' TRP . 94.9 t -75.47 112.2 12.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 107.673 -1.232 . . . . 63.33 107.673 175.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -102.34 -179.1 3.89 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.278 -0.874 . . . . 74.34 112.936 -171.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -63.84 100.82 0.32 Allowed 'General case' 0 C--O 1.244 0.779 0 CA-C-N 115.091 -0.959 . . . . 53.14 111.744 -175.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.0 m -93.62 150.77 20.15 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 114.715 -1.129 . . . . 70.41 108.703 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 0.43 4.79 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 115.267 1.58 . . . . 71.34 115.267 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.52 -16.19 29.32 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.946 -0.761 . . . . 73.32 108.946 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 114.26 13.96 9.45 Favored Glycine 0 N--CA 1.427 -1.902 0 CA-C-N 115.583 -0.735 . . . . 51.51 112.391 -177.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 79.5 m -78.66 107.95 11.72 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.768 -1.197 . . . . 62.11 107.768 173.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -83.14 162.79 21.18 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 107.886 -1.153 . . . . 53.25 107.886 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.46 151.1 4.17 Favored 'Isoleucine or valine' 0 C--O 1.253 1.266 0 N-CA-C 106.922 -1.51 . . . . 62.23 106.922 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.447 HG22 ' HG ' ' A' ' 169' ' ' LEU . 42.1 mm -94.09 95.05 4.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.876 0 N-CA-C 108.169 -1.049 . . . . 74.25 108.169 -177.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -112.27 -10.59 13.81 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 114.772 -1.104 . . . . 74.42 111.612 -176.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.514 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 45.3 t-20 -137.13 152.02 49.5 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.339 -1.356 . . . . 71.23 107.339 177.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.557 ' CG2' ' HA ' ' A' ' 166' ' ' ASP . 8.7 tt -67.05 -18.26 23.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 121.249 0.547 . . . . 63.12 110.556 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.402 ' HD2' ' CG ' ' A' ' 166' ' ' ASP . 16.1 ptmt -88.86 19.06 4.28 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.201 0.524 . . . . 71.41 111.362 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -85.44 155.88 21.07 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.605 -0.725 . . . . 75.41 109.577 -179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.46 -38.68 69.37 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 113.118 0.784 . . . . 74.55 113.118 -170.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.502 ' HD3' ' HA ' ' A' ' 149' ' ' ARG 0.299 23.5 mmt180 -84.29 -21.3 31.1 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 118.662 -1.215 . . . . 74.41 113.521 -175.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.431 ' HB ' ' O ' ' A' ' 145' ' ' ILE . 0.2 OUTLIER -74.51 -41.73 60.17 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 107.498 -1.297 . . . . 73.34 107.498 173.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 155' ' ' VAL . 16.1 m-80 -57.34 -40.83 78.84 Favored 'General case' 0 C--O 1.207 -1.145 0 CA-C-N 115.059 -0.973 . . . . 71.24 110.618 176.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 32.2 m -56.28 -37.24 69.59 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.44 0.463 . . . . 62.34 111.813 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -82.15 -40.21 22.13 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.347 -0.612 . . . . 74.23 109.347 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.448 ' CE2' HD11 ' A' ' 145' ' ' ILE . 11.9 m-85 -65.69 -45.43 82.84 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.14 -0.936 . . . . 72.22 112.083 -177.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 151' ' ' ASN . 31.1 m -63.92 -38.71 83.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 N-CA-C 112.141 0.423 . . . . 64.25 112.141 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.29 -29.37 67.22 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 71.3 111.498 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.623 ' ND1' HD12 ' A' ' 27' ' ' LEU . 12.5 m-70 -88.12 -5.87 58.2 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.978 1.473 . . . . 72.55 114.978 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 117.14 -10.7 14.98 Favored Glycine 0 CA--C 1.492 -1.35 0 C-N-CA 119.197 -1.478 . . . . 73.24 112.788 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -77.76 116.99 18.72 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.689 -0.856 . . . . 63.32 108.689 -177.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -84.53 146.75 27.4 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 120.12 -0.632 . . . . 63.43 109.539 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.85 -22.78 31.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 123.605 0.762 . . . . 64.22 111.532 -174.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.4 -23.53 46.71 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 112.303 0.483 . . . . 73.11 112.303 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -98.6 -23.45 15.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 112.505 0.558 . . . . 62.35 112.505 -178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.48 144.05 38.04 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 119.484 -0.886 . . . . 75.45 110.266 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.573 ' HB2' ' N ' ' A' ' 87' ' ' THR . 50.2 t30 -106.74 146.24 31.08 Favored 'General case' 0 C--N 1.293 -1.865 0 C-N-CA 124.315 1.046 . . . . 71.21 108.446 -175.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.557 ' HA ' ' CG2' ' A' ' 145' ' ' ILE . 2.1 p-10 -100.72 127.92 46.96 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-O 122.24 1.019 . . . . 73.22 113.66 -176.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 145' ' ' ILE . 15.2 m -137.64 167.33 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 C-N-CA 126.107 1.763 . . . . 74.51 107.214 175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 14.0 p -67.12 144.07 56.28 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 121.188 0.518 . . . . 73.41 111.042 178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.447 ' HG ' HG22 ' A' ' 142' ' ' ILE . 2.3 tm? -67.04 -35.0 78.92 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.088 -0.96 . . . . 75.11 108.68 -175.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.17 -43.4 87.01 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.489 -0.778 . . . . 75.45 109.815 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -68.89 -39.26 79.85 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 108.842 -0.799 . . . . 63.13 108.842 -177.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.26 -43.96 89.63 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.331 -0.85 . . . . 64.11 110.688 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -67.18 -33.86 76.3 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 116.232 -0.44 . . . . 72.1 111.238 -177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.2 m -70.99 -44.12 66.6 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 116.219 -0.446 . . . . 43.13 110.33 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 11.6 p -69.42 -36.36 71.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 119.649 -0.82 . . . . 74.25 111.297 -177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.43 -34.72 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 119.529 -0.868 . . . . 73.22 110.78 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.454 ' OD1' ' HE3' ' A' ' 123' ' ' LYS . 7.9 t30 -67.88 -45.08 75.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.359 -0.536 . . . . 73.22 110.274 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -72.15 -23.02 61.23 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.38 -0.373 . . . . 71.14 111.401 -176.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 81' ' ' LEU . 63.6 tp -74.22 -48.6 27.88 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 116.168 -0.469 . . . . 63.44 110.019 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 32.9 m -76.82 -17.95 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 N-CA-C 112.488 0.551 . . . . 72.1 112.488 -176.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 17.8 m -107.45 11.4 28.92 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 113.91 1.078 . . . . 75.11 113.91 -175.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.444 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 30.3 p80 -85.38 152.45 23.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 117.559 -1.657 . . . . 73.32 110.128 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -55.25 -38.3 68.34 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.246 1.202 . . . . 60.52 114.246 -175.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.444 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 21.8 t70 -67.73 -41.65 83.14 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-O 120.91 0.386 . . . . 70.1 110.689 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 53.2 tpp -65.29 -45.56 83.96 Favored 'General case' 0 C--O 1.2 -1.518 0 CA-C-N 115.387 -0.824 . . . . 74.43 110.036 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 76.1 mt -64.26 -40.5 89.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 116.51 -0.314 . . . . 75.13 110.671 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.48 ' OH ' ' HB3' ' A' ' 63' ' ' LYS . 61.6 t80 -66.07 -45.49 81.12 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.985 -0.552 . . . . 74.25 111.036 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . . . . . . . . . 41.6 mm -72.33 -38.22 60.66 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 121.157 0.503 . . . . 74.21 109.812 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.87 -41.91 95.27 Favored 'General case' 0 C--O 1.205 -1.266 0 CA-C-N 116.05 -0.523 . . . . 74.14 111.452 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . 0.554 ' O ' ' HG2' ' A' ' 194' ' ' GLN . 30.1 t70 -70.82 -39.23 73.15 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 119.002 -1.079 . . . . 73.03 110.667 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.02 93.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.767 0.318 . . . . 75.1 110.472 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.35 -33.04 69.23 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 116.041 -0.527 . . . . 43.3 111.391 178.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -64.92 -44.43 89.55 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.376 -0.601 . . . . 64.11 109.376 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 190' ' ' ASP . 62.8 mm-40 -69.18 -37.04 77.95 Favored 'General case' 0 CA--C 1.509 -0.612 0 C-N-CA 120.381 -0.528 . . . . 63.45 109.884 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -63.4 -47.75 80.7 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.453 -0.794 . . . . 74.24 110.55 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.68 -28.2 30.32 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.148 0 C-N-CA 120.713 -0.395 . . . . 74.32 110.482 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.17 -43.0 88.15 Favored 'General case' 0 C--O 1.245 0.828 0 CA-C-O 120.879 0.371 . . . . 73.53 110.44 176.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 194' ' ' GLN . 67.3 mttm -69.24 -42.35 75.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 116.105 -0.498 . . . . 64.53 109.663 178.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . 0.464 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 37.3 m0 -67.65 -38.17 83.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.598 0.592 . . . . 65.25 112.598 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . 0.41 ' HA ' ' HG3' ' A' ' 203' ' ' GLU . 8.9 t -71.24 -28.64 64.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.053 -0.659 . . . . 72.1 109.953 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 204' ' ' SER . 87.1 tttt -74.16 -40.37 62.61 Favored 'General case' 0 N--CA 1.436 -1.161 0 N-CA-C 108.762 -0.829 . . . . 73.13 108.762 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.17 -48.99 79.01 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.225 -0.898 . . . . 70.13 110.625 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 3.0 pp20? -70.36 -27.06 64.04 Favored 'General case' 0 CA--C 1.491 -1.316 0 C-N-CA 120.305 -0.558 . . . . 70.21 111.059 -177.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 201' ' ' LYS . 30.5 t -61.01 -56.04 25.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 115.429 -0.805 . . . . 73.13 109.474 173.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -68.63 -32.48 72.37 Favored 'General case' 0 C--N 1.311 -1.075 0 C-N-CA 120.473 -0.491 . . . . 74.24 111.221 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 -72.44 -38.94 68.17 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 116.014 -0.539 . . . . 44.1 111.754 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.55 -33.96 41.42 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 119.682 -0.807 . . . . 72.31 110.476 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 212' ' ' GLU . . . -66.17 -44.66 83.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 116.113 -0.494 . . . . 72.14 110.306 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . 0.535 ' O ' ' HG2' ' A' ' 213' ' ' GLN . 53.0 ttm -63.71 -40.66 97.32 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.52 -0.472 . . . . 53.14 110.07 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 25.2 ttt -65.58 -38.84 90.67 Favored 'General case' 0 C--O 1.209 -1.066 0 CA-C-N 116.105 -0.498 . . . . 70.4 110.873 179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -67.94 -34.69 77.07 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.833 0.349 . . . . 71.45 111.163 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 208' ' ' ALA . 43.9 mt-10 -76.7 -50.16 14.33 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.732 0.641 . . . . 74.44 112.732 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 209' ' ' MET . 19.6 pt20 -104.25 17.56 23.88 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.41 0.624 . . . . 64.34 112.611 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . -146.28 -123.44 1.51 Allowed Glycine 0 N--CA 1.428 -1.874 0 N-CA-C 110.319 -1.112 . . . . 61.21 110.319 176.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 40.4 pt -119.94 158.33 21.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-O 120.934 0.397 . . . . 71.43 110.309 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 16.5 m -100.21 123.62 44.67 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 108.395 -0.965 . . . . 61.1 108.395 177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -80.99 97.77 1.79 Allowed Glycine 0 N--CA 1.439 -1.126 0 N-CA-C 111.235 -0.746 . . . . 70.35 111.235 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -132.83 98.35 4.29 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 120.704 0.288 . . . . 62.53 110.819 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 87.3 tttt 178.19 144.12 0.11 Allowed 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 125.225 1.41 . . . . 71.43 107.984 174.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -142.75 -142.99 4.1 Favored Glycine 0 N--CA 1.412 -2.962 0 N-CA-C 110.891 -0.884 . . . . 52.44 110.891 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.95 -60.67 0.23 Allowed 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 108.889 -0.782 . . . . 65.04 108.889 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 40.0 tttp 72.35 128.31 0.03 OUTLIER 'General case' 0 C--O 1.247 0.972 0 O-C-N 124.508 1.13 . . . . 65.0 111.583 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 C--N 1.29 -2.008 0 N-CA-C 105.077 -2.194 . . . . 63.33 105.077 173.558 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.444 -0.727 0 CA-C-O 120.427 0.156 . . . . 70.42 111.079 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t -160.85 151.58 18.4 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.18 -1.044 . . . . 72.5 108.18 178.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.03 -171.47 35.03 Favored Glycine 0 N--CA 1.429 -1.771 0 N-CA-C 109.82 -1.312 . . . . 73.53 109.82 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 67.8 mt -79.4 124.8 38.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 108.212 -1.033 . . . . 62.33 108.212 178.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.33 101.58 10.66 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.769 0.795 . . . . 71.24 110.055 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.42 17.04 59.69 Favored Glycine 0 C--N 1.314 -0.652 0 CA-C-N 115.293 -0.867 . . . . 61.34 111.609 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.9 p -83.79 102.87 12.63 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 123.233 0.613 . . . . 43.44 109.54 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 8.8 t -144.86 25.21 1.46 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.893 0.854 . . . . 73.44 109.71 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -78.45 132.51 37.32 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.051 -0.977 . . . . 73.42 109.155 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -70.53 135.07 48.27 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.991 -0.55 . . . . 61.15 110.224 -177.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.54 -33.26 42.04 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.899 -0.591 . . . . 74.25 111.641 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 2.2 mptp? -67.34 144.7 55.71 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 71.13 113.152 -166.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -96.76 174.11 6.97 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.086 -0.961 . . . . 73.31 109.62 -175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -73.05 -56.44 5.12 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.89 -0.595 . . . . 72.44 111.307 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 44.5 m -145.58 108.66 4.57 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.379 0.609 . . . . 73.43 110.307 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.5 t -84.45 86.69 2.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.62 -0.718 . . . . 63.41 109.34 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.0 t -126.55 97.42 4.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 N-CA-C 107.784 -1.191 . . . . 55.22 107.784 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -104.83 96.65 6.7 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 109.643 -0.503 . . . . 64.54 109.643 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 153.75 91.57 0.08 OUTLIER Glycine 0 N--CA 1.433 -1.539 0 C-N-CA 120.188 -1.006 . . . . 71.05 111.697 -178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.36 169.26 9.47 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.835 -0.802 . . . . 64.03 108.835 177.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 m -98.21 106.02 18.25 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 109.489 -0.559 . . . . 74.22 109.489 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.4 p -84.52 99.04 10.46 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.246 0.546 . . . . 61.45 110.863 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.2 t -86.95 137.45 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 108.103 -1.073 . . . . 55.51 108.103 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 69.36 101.54 0.06 Allowed 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.733 1.213 . . . . 73.33 110.477 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.88 176.28 7.98 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.162 -0.926 . . . . 55.04 110.903 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 18.6 m -67.42 166.72 14.0 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 114.991 -1.004 . . . . 64.1 109.603 -176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.576 ' O ' HG12 ' A' ' 31' ' ' ILE . 3.4 mm? -65.16 -20.88 66.66 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 112.12 0.415 . . . . 64.34 112.12 -175.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HG3' ' OE2' ' A' ' 29' ' ' GLU . 17.9 tptp -67.94 -48.31 66.27 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.564 -0.532 . . . . 71.34 109.564 176.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.504 ' OE2' ' HG3' ' A' ' 28' ' ' LYS . 1.7 mp0 -73.13 -20.69 60.87 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.063 -0.517 . . . . 73.13 111.042 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -70.51 -36.15 73.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.045 -1.094 . . . . 72.43 108.045 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 27' ' ' LEU . 48.7 mm -65.75 -38.68 82.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 108.47 -0.937 . . . . 74.05 108.47 173.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.23 -42.98 92.33 Favored 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.809 175.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 111' ' ' VAL . 65.7 t90 -62.62 -45.68 91.76 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.421 -0.585 . . . . 62.41 109.421 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.74 -41.85 97.97 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.506 -0.77 . . . . 50.35 110.464 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.39 -36.53 71.42 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.408 -0.815 . . . . 65.14 110.135 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.94 -35.48 78.49 Favored 'General case' 0 C--O 1.202 -1.428 0 N-CA-C 109.564 -0.532 . . . . 63.01 109.564 178.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.77 -38.77 80.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 116.124 -0.489 . . . . 71.01 109.773 -177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -77.12 -27.08 53.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.29 0.567 . . . . 74.12 110.665 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 10.3 t -100.37 23.8 9.7 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.233 0.539 . . . . 55.34 110.372 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -98.1 124.66 42.73 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.564 -0.902 . . . . 64.15 108.564 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -83.54 121.29 27.02 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 109.701 -0.481 . . . . 63.24 109.701 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -128.48 31.99 4.91 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 107.522 -1.288 . . . . 55.0 107.522 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.1 m -74.55 -15.51 60.85 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.592 -1.185 . . . . 64.54 109.533 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.84 -6.32 57.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.327 -0.852 . . . . 74.45 110.437 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -93.72 139.79 30.41 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.516 -0.92 . . . . 74.13 108.516 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -94.33 106.29 18.27 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.548 -1.279 . . . . 73.21 107.548 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.594 HG21 ' HG3' ' A' ' 99' ' ' ARG . 30.6 p -88.38 79.97 7.59 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-O 121.63 0.729 . . . . 54.55 111.611 -174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.2 p -72.78 95.32 1.89 Allowed 'General case' 0 N--CA 1.426 -1.674 0 CA-C-N 114.66 -1.155 . . . . 45.02 111.206 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . 0.261 15.1 ptmm? 45.01 67.91 0.64 Allowed 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 126.267 1.827 . . . . 75.02 113.533 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 99' ' ' ARG . 20.1 m0 -69.67 100.2 1.44 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.357 -0.838 . . . . 74.54 110.13 174.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 20.9 m120 -89.12 62.73 6.34 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-O 122.082 0.944 . . . . 75.33 110.107 178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.6 m -78.72 -37.67 40.9 Favored 'General case' 0 N--CA 1.422 -1.85 0 N-CA-C 106.327 -1.731 . . . . 73.23 106.327 175.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 57' ' ' LYS . 8.1 p-10 -61.24 -40.44 94.03 Favored 'General case' 0 C--O 1.198 -1.639 0 CA-C-N 113.884 -1.507 . . . . 71.13 109.099 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 12.7 tp10 -72.45 -33.36 66.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 116.037 -0.529 . . . . 73.33 111.154 -175.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.04 -40.03 71.95 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.561 -0.456 . . . . 74.35 110.388 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.511 HG21 ' HB ' ' A' ' 67' ' ' ILE . 34.0 m -75.53 -19.66 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.214 0 C-N-CA 118.867 -1.133 . . . . 63.44 110.85 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 61' ' ' ASN . 53.3 mtpt -69.54 -18.95 63.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.357 0.599 . . . . 74.02 110.321 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -90.94 -38.83 12.62 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 109.38 -0.6 . . . . 65.13 109.38 174.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.45 -32.39 60.63 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 113.704 1.002 . . . . 72.14 113.704 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.42 ' HG ' ' ND2' ' A' ' 195' ' ' ASN . 5.2 mp -128.39 10.2 6.2 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.893 -0.504 . . . . 74.04 111.823 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 57' ' ' LYS . 40.0 m-80 70.75 -169.09 0.16 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.166 -0.679 . . . . 75.31 109.166 -175.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.59 -10.4 35.2 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.205 0.446 . . . . 71.41 112.205 -175.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -62.07 -14.43 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.033 0.753 . . . . 74.52 113.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.08 13.85 28.57 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 123.161 0.584 . . . . 54.44 111.819 -178.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.5 p -52.79 128.42 11.99 Favored 'Isoleucine or valine' 0 C--O 1.253 1.257 0 CA-C-O 121.774 0.797 . . . . 75.43 112.51 -179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.76 53.95 10.8 Favored Glycine 0 CA--C 1.501 -0.792 0 CA-C-N 114.487 -1.233 . . . . 42.54 110.799 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.511 ' HB ' HG21 ' A' ' 56' ' ' VAL . 11.1 tp -71.13 -38.68 72.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 112.635 0.606 . . . . 74.11 112.635 -172.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.409 ' O ' HD13 ' A' ' 72' ' ' LEU . 0.1 OUTLIER -73.17 -37.18 66.64 Favored 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 109.184 -0.673 . . . . 74.12 109.184 -178.088 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.1 m -66.98 -36.94 83.3 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.586 -0.733 . . . . 75.42 109.453 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -63.9 -47.96 78.51 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.267 -0.878 . . . . 72.45 109.208 177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.31 -36.38 83.89 Favored 'General case' 0 C--O 1.198 -1.632 0 CA-C-N 115.711 -0.677 . . . . 71.1 111.254 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 68' ' ' GLU . 6.3 mp -63.52 -48.69 76.52 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 123.311 0.382 . . . . 62.22 111.23 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.54 -36.99 79.58 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.802 -0.359 . . . . 55.52 111.722 -176.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.6 mt -79.56 -33.5 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.374 0 C-N-CA 120.368 -0.533 . . . . 74.31 110.785 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.86 -33.36 70.54 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.115 -0.634 . . . . 73.11 109.495 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' A' ' 76' ' ' LYS . 33.3 ttpt -54.45 -48.38 71.79 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 109.087 -0.708 . . . . 64.22 109.087 169.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.695 ' O ' ' HG ' ' A' ' 81' ' ' LEU . 41.5 mt-10 -61.29 -38.25 86.12 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.832 -0.622 . . . . 74.22 111.122 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -69.33 -35.08 75.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.686 0.279 . . . . 60.12 111.742 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -67.16 -40.03 86.61 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.586 -0.894 . . . . 72.32 108.586 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -64.94 -33.49 76.14 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.398 -0.964 . . . . 55.05 108.398 177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 77' ' ' GLU . 88.0 mt -70.61 -46.04 64.14 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.411 -0.359 . . . . 54.33 110.599 176.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.54 -39.31 93.2 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-O 120.65 0.262 . . . . 71.24 111.154 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 26.3 p -65.55 -25.3 67.37 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 112.222 0.453 . . . . 72.11 112.222 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.6 t -87.46 -42.08 14.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-O 121.097 0.475 . . . . 53.04 110.85 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -85.0 -19.15 32.46 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 112.758 0.651 . . . . 64.1 112.758 -173.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 83.0 m -111.64 142.65 43.69 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 108.795 -0.817 . . . . 52.34 108.795 175.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.8 t -88.78 132.11 34.77 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 119.329 -0.948 . . . . 61.14 112.117 -175.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 85.81 17.98 60.63 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 115.738 -0.664 . . . . 74.31 112.194 176.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.3 t -101.87 130.18 51.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 120.388 -0.525 . . . . 65.11 110.475 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -70.2 148.16 48.96 Favored 'General case' 0 C--O 1.216 -0.67 0 C-N-CA 124.265 1.026 . . . . 62.52 109.59 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -105.77 -8.87 17.55 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.351 0.596 . . . . 63.32 112.226 -176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.3 p -135.24 91.09 19.57 Favored Pre-proline 0 C--N 1.29 -2.009 0 CA-C-N 115.858 -0.61 . . . . 71.1 109.971 -177.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -79.12 160.34 26.65 Favored 'Trans proline' 0 N--CA 1.436 -1.855 0 C-N-CA 121.992 1.795 . . . . 63.24 112.933 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 -41.83 9.87 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 107.412 -1.329 . . . . 54.2 107.412 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.454 ' O ' ' HA ' ' A' ' 39' ' ' SER . 38.3 m80 -84.69 100.76 11.69 Favored 'General case' 0 CA--C 1.487 -1.445 0 N-CA-C 106.881 -1.526 . . . . 53.43 106.881 176.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 39.9 t -120.25 134.23 64.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.017 0 CA-C-N 115.297 -0.865 . . . . 63.42 109.883 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.65 141.52 58.36 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.625 -0.716 . . . . 74.2 110.553 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -110.02 -31.45 7.37 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.374 0.607 . . . . 73.3 111.016 177.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.716 ' HB3' ' CZ3' ' A' ' 50' ' ' TRP . 27.3 mmt180 -135.39 145.75 47.63 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.116 -0.493 . . . . 64.13 111.861 -173.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.5 t -122.26 123.24 68.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 N-CA-C 107.096 -1.446 . . . . 55.01 107.096 177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 1.2 m -78.86 160.54 71.43 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 108.012 -1.107 . . . . 60.41 108.012 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 106' ' ' ILE . 58.4 Cg_exo -55.04 -37.04 94.09 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.556 2.171 . . . . 73.45 112.472 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -67.51 -44.13 84.3 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.482 -0.781 . . . . 74.24 111.402 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.476 ' O ' ' HG2' ' A' ' 108' ' ' MET . 25.2 m-20 -63.91 -38.6 91.67 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 108.921 -0.77 . . . . 75.3 108.921 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 109' ' ' LEU . . . -60.09 -41.29 92.18 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 115.063 -0.972 . . . . 51.22 111.092 -177.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 102' ' ' PRO . 50.2 mm -57.74 -46.14 86.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.702 -0.481 . . . . 74.21 109.702 178.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 47.4 m -66.53 -41.27 89.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.029 -0.532 . . . . 74.34 110.618 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' ASP . 96.4 mmm -62.37 -43.78 98.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.678 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 105' ' ' ALA . 10.2 mp -64.91 -36.65 85.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 74.53 111.536 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.436 ' HD1' ' O ' ' A' ' 106' ' ' ILE . 28.2 m-85 -69.09 -45.2 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.52 -0.472 . . . . 72.05 111.026 175.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.45 HG21 ' CZ3' ' A' ' 33' ' ' TRP . 80.0 t -64.08 -39.07 84.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 112.208 0.448 . . . . 75.1 112.208 -177.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.66 -39.29 84.55 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.935 -0.706 . . . . 51.21 111.841 178.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' ' 192' ' ' MET . 19.0 m -66.77 -43.99 82.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 116.353 -0.385 . . . . 52.32 110.705 -178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' HG2' ' A' ' 118' ' ' GLU . 13.9 tt -70.21 -38.42 74.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.327 -0.397 . . . . 62.42 110.342 -178.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 87.3 m -68.81 -41.07 79.17 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.508 -0.315 . . . . 40.14 111.398 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 180' ' ' VAL . 13.4 t-160 -73.12 -27.62 61.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 119.515 -0.874 . . . . 75.43 109.366 -178.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.6 ttt85 -67.87 -43.77 78.63 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 63.03 109.363 174.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.603 ' HA ' ' OG ' ' A' ' 121' ' ' SER 0.704 0.0 OUTLIER -69.62 -21.02 63.6 Favored 'General case' 0 C--O 1.201 -1.486 0 N-CA-C 117.431 2.382 . . . . 71.31 117.431 170.534 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 115' ' ' THR . 91.2 mt -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.863 -0.792 . . . . 71.42 108.863 169.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.3 t -68.38 -38.9 81.82 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.636 -0.711 . . . . 54.34 110.054 178.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.603 ' OG ' ' HA ' ' A' ' 118' ' ' GLU . 12.3 p -77.87 -25.91 48.93 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 121.909 -0.494 . . . . 73.54 111.391 177.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 118' ' ' GLU . 4.9 tt -62.55 -43.75 98.04 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 105.852 -1.907 . . . . 74.25 105.852 172.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -60.94 -44.31 97.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.807 -1.088 . . . . 72.11 111.116 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -59.21 -36.93 76.28 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.272 -0.64 . . . . 64.12 109.272 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 129' ' ' TRP . 75.1 mmtt -70.39 -40.65 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.353 -0.84 . . . . 72.14 110.618 175.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 122' ' ' LEU . 63.8 mt -53.42 -52.6 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.926 0 N-CA-C 109.605 -0.517 . . . . 64.51 109.605 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -65.59 -34.01 77.24 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.875 -0.602 . . . . 74.33 110.3 -176.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -50.24 66.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.263 -0.88 . . . . 73.54 110.531 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 125' ' ' LYS 0.53 0.5 OUTLIER -82.23 -17.87 44.56 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 115.756 1.762 . . . . 63.25 115.756 176.929 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -72.46 -23.09 61.0 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.985 -1.117 . . . . 64.14 107.985 172.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -75.23 -24.03 57.64 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.257 -1.016 . . . . 75.12 108.257 174.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.43 ' HB ' ' O ' ' A' ' 129' ' ' TRP . 91.0 t -78.82 136.97 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-N 114.321 -1.308 . . . . 75.21 107.806 175.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.421 ' HA ' HG12 ' A' ' 141' ' ' VAL . 16.4 pttm -147.87 -171.44 3.82 Favored 'General case' 0 N--CA 1.417 -2.089 0 CA-C-N 115.843 -0.617 . . . . 63.22 109.435 -172.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -55.58 104.52 0.13 Allowed 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.254 0.971 . . . . 70.44 110.237 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.6 m -119.13 163.03 17.65 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.971 -1.013 . . . . 60.22 109.178 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 136' ' ' GLU . 0.8 OUTLIER -67.15 -11.22 56.67 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 114.005 1.113 . . . . 64.25 114.005 -174.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -87.47 0.39 55.61 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.164 0.507 . . . . 75.1 110.185 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 94.11 9.16 59.67 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.933 -0.867 . . . . 53.12 110.933 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 0.8 OUTLIER -71.39 149.36 46.06 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.376 -0.972 . . . . 42.14 108.376 -178.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 46.9 mttm -132.56 169.12 17.05 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 107.91 -1.144 . . . . 65.15 107.91 -172.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.421 HG12 ' HA ' ' A' ' 133' ' ' LYS . 27.5 m -76.47 146.23 9.17 Favored 'Isoleucine or valine' 0 C--O 1.248 1.023 0 N-CA-C 108.042 -1.096 . . . . 72.32 108.042 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 9.4 tt -70.32 96.44 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 CA-C-O 122.417 1.104 . . . . 64.14 110.865 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.27 -36.15 22.87 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 122.404 1.097 . . . . 52.04 109.237 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . 0.533 ' OD1' ' HB2' ' A' ' 166' ' ' ASP . 34.2 t-20 -142.6 155.03 44.92 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 106.149 -1.797 . . . . 64.12 106.149 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.405 ' O ' ' HB ' ' A' ' 150' ' ' THR . 63.5 mt -57.16 -25.96 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.985 0.914 . . . . 64.12 110.322 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 166' ' ' ASP . 4.1 tppp? -71.05 34.0 0.05 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.171 1.388 . . . . 54.42 113.227 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -93.6 152.08 19.25 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.583 -0.895 . . . . 75.43 108.583 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -56.41 -37.09 69.69 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 123.711 0.804 . . . . 75.5 111.326 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.02 -42.8 25.66 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 116.285 -0.416 . . . . 74.31 110.266 -176.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.439 ' O ' ' HD1' ' A' ' 154' ' ' PHE . 4.5 m -69.15 -40.83 77.97 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.357 -0.838 . . . . 75.25 110.331 -177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 155' ' ' VAL . 95.6 m-20 -62.99 -37.56 87.64 Favored 'General case' 0 C--O 1.204 -1.296 0 N-CA-C 109.703 -0.48 . . . . 72.15 109.703 179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 86.5 m -59.85 -38.11 81.19 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.986 0.365 . . . . 64.12 111.986 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.403 ' CZ3' ' HG ' ' A' ' 122' ' ' LEU . 89.2 t90 -71.73 -43.64 65.52 Favored 'General case' 0 CA--C 1.496 -1.134 0 C-N-CA 119.769 -0.772 . . . . 72.43 109.467 176.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.47 ' HB3' ' HB2' ' A' ' 159' ' ' PHE . 35.0 m-85 -61.62 -48.14 82.24 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 124.082 0.864 . . . . 71.42 112.361 -178.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 151' ' ' ASN . 27.3 m -64.93 -36.03 76.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 112.951 0.722 . . . . 54.03 112.951 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.94 -29.35 65.35 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.562 0.696 . . . . 63.34 110.392 178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.572 ' ND1' ' HE1' ' A' ' 159' ' ' PHE . 1.4 t-80 -82.68 -12.32 57.7 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.076 -0.966 . . . . 70.4 109.079 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 115.03 -10.57 20.62 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.147 -0.933 . . . . 64.02 114.075 173.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.572 ' HE1' ' ND1' ' A' ' 157' ' ' HIS . 46.6 m-85 -77.53 100.67 6.16 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.628 -0.879 . . . . 74.54 108.628 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -70.4 141.31 52.17 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.518 -0.765 . . . . 71.52 109.094 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 63.8 t -55.85 -32.11 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 113.713 1.005 . . . . 75.45 113.713 -171.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -89.23 -12.31 41.16 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.658 -0.817 . . . . 71.33 111.721 -178.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -94.75 -32.34 13.37 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 112.634 0.605 . . . . 75.25 112.634 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -82.79 154.43 24.73 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 118.589 -1.244 . . . . 72.51 109.717 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -94.7 121.43 36.26 Favored 'General case' 0 C--N 1.276 -2.606 0 N-CA-C 105.88 -1.896 . . . . 70.21 105.88 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.533 ' HB2' ' OD1' ' A' ' 144' ' ' ASN . 4.1 p30 -81.03 108.57 14.82 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.336 -0.946 . . . . 74.15 110.8 -178.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.403 ' H ' HD12 ' A' ' 145' ' ' ILE . 39.6 t -103.89 154.8 5.82 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 107.918 -1.142 . . . . 62.51 107.918 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 9.1 p -66.37 143.83 56.91 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 109.146 -0.687 . . . . 74.0 109.146 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.419 HD21 HG23 ' A' ' 126' ' ' ILE . 3.3 tm? -65.96 -32.91 74.67 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 116.029 -0.532 . . . . 71.32 110.469 -174.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -25.46 62.96 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.74 -0.784 . . . . 71.15 111.795 -179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 175' ' ' VAL . 24.3 tptm -83.01 -43.35 16.45 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.157 -0.683 . . . . 73.23 109.157 175.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -42.46 98.26 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.826 -0.625 . . . . 61.51 109.795 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -63.15 -40.95 99.04 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.46 -0.336 . . . . 45.11 110.928 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 5.9 p -71.52 -28.77 64.11 Favored 'General case' 0 N--CA 1.44 -0.97 0 C-N-CA 120.69 -0.404 . . . . 75.35 111.797 -179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.586 ' O ' ' HG ' ' A' ' 179' ' ' LEU . 87.8 t -67.59 -49.9 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.578 -0.527 . . . . 61.55 109.578 172.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 64.4 t -64.21 -33.57 63.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 120.977 0.417 . . . . 52.42 110.519 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -58.75 -42.75 89.59 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 123.613 0.765 . . . . 60.21 110.62 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.31 -20.64 47.43 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 116.5 -0.318 . . . . 75.03 111.455 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 175' ' ' VAL . 87.8 mt -77.79 -42.16 34.89 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 111.782 0.29 . . . . 74.02 111.782 175.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . 0.564 ' HA ' ' HE2' ' A' ' 116' ' ' HIS . 32.6 m -77.72 -22.84 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 C-N-CA 119.932 -0.707 . . . . 44.32 111.222 -179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 40.0 m -102.9 13.62 33.92 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.077 0.465 . . . . 73.14 110.786 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -69.89 110.44 5.01 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 106.39 -1.708 . . . . 74.31 106.39 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -64.47 -33.55 76.14 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.8 1.037 . . . . 71.53 113.8 -173.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.24 -48.29 29.74 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.548 -0.908 . . . . 74.23 108.548 -177.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 49.3 ttm -66.31 -38.66 88.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.169 -1.378 . . . . 74.23 111.607 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 15.4 tt -75.4 -31.09 23.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 C-N-CA 120.239 -0.585 . . . . 72.32 110.001 -179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -64.65 -48.4 74.97 Favored 'General case' 0 C--O 1.252 1.212 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.064 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.435 ' O ' ' HB2' ' A' ' 192' ' ' MET . 2.5 pp -68.15 -38.28 79.46 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.8 0 C-N-CA 119.586 -0.846 . . . . 54.33 110.444 178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . 0.418 ' N ' HD12 ' A' ' 188' ' ' ILE . 41.1 t-20 -59.83 -45.3 92.81 Favored 'General case' 0 C--O 1.204 -1.329 0 N-CA-C 109.892 -0.41 . . . . 74.23 109.892 178.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -63.18 -39.72 95.46 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 112.033 0.383 . . . . 62.23 112.033 -178.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -78.04 -37.29 47.17 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.227 0.537 . . . . 41.35 110.518 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.488 ' HB3' ' OG ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -62.79 -47.49 83.26 Favored 'General case' 0 CA--C 1.487 -1.471 0 CA-C-N 115.287 -0.87 . . . . 34.21 110.15 178.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . 0.629 ' HA ' HG22 ' A' ' 196' ' ' VAL . 61.6 tttm -64.46 -37.62 88.17 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 123.435 0.459 . . . . 73.3 110.697 -175.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -65.46 -40.45 93.21 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 120.081 -0.648 . . . . 74.33 109.364 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.42 ' ND2' ' HG ' ' A' ' 60' ' ' LEU . 4.1 m-20 -72.84 -36.41 67.45 Favored 'General case' 0 C--O 1.195 -1.801 0 C-N-CA 119.307 -0.957 . . . . 64.21 113.464 177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 193' ' ' LYS . 16.7 m -68.73 -33.66 60.74 Favored 'Isoleucine or valine' 0 C--O 1.248 0.984 0 CA-C-N 119.28 0.945 . . . . 70.34 110.958 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -74.53 -31.26 62.07 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.061 0.457 . . . . 64.12 109.959 176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -71.12 -45.15 64.17 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-N 115.916 -0.584 . . . . 75.34 109.948 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -65.95 -32.63 74.23 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 113.492 0.923 . . . . 73.1 113.492 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.0 t -68.69 -31.9 71.33 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 119.018 -1.073 . . . . 74.1 108.949 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.78 -44.82 61.09 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.408 -0.815 . . . . 71.11 109.357 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.64 -37.55 85.06 Favored 'General case' 0 C--O 1.201 -1.488 0 CA-C-N 115.575 -0.738 . . . . 61.45 109.492 -177.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -64.19 -47.13 80.99 Favored 'General case' 0 C--O 1.206 -1.202 0 C-N-CA 120.662 -0.415 . . . . 72.23 110.859 175.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 7.3 p -67.13 -30.93 71.06 Favored 'General case' 0 C--N 1.314 -0.977 0 C-N-CA 119.871 -0.732 . . . . 54.12 111.61 -177.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -74.83 -45.14 45.3 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.653 -0.703 . . . . 62.02 110.474 176.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -67.12 -41.43 86.19 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 109.789 -0.449 . . . . 75.25 109.789 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.58 -28.81 67.27 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.892 0.377 . . . . 75.01 110.515 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 212' ' ' GLU . . . -70.35 -42.65 71.56 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.907 -0.775 . . . . 51.33 108.907 175.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 53.6 ttm -65.73 -33.75 76.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.433 0.635 . . . . 62.2 110.343 176.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 85.7 mtp -68.8 -29.53 67.91 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.669 176.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 214' ' ' GLY . . . -75.75 -24.56 56.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.457 0.646 . . . . 32.03 110.014 174.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 208' ' ' ALA . 16.9 mm-40 -70.57 -37.98 74.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.393 -0.965 . . . . 54.35 108.393 173.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.26 -48.68 69.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.109 -0.95 . . . . 72.11 108.553 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' A' ' 211' ' ' ALA . . . 168.54 -91.01 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.384 0 N-CA-C 108.766 -1.734 . . . . 35.15 108.766 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 20.5 pt -140.39 -39.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 108.155 -1.054 . . . . 73.41 108.155 171.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 22.8 t 69.15 155.11 0.12 Allowed 'General case' 0 C--O 1.25 1.103 0 C-N-CA 124.891 1.276 . . . . 72.41 111.948 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . -115.45 67.46 0.28 Allowed Glycine 0 N--CA 1.422 -2.279 0 N-CA-C 110.092 -1.203 . . . . 72.24 110.092 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -148.52 108.97 4.15 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.263 -0.643 . . . . 65.33 109.263 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.94 150.6 49.27 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.966 -0.753 . . . . 65.34 108.966 178.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -112.34 84.19 0.35 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 120.408 -0.901 . . . . 74.55 112.692 -177.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -149.59 145.86 27.01 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 108.468 -0.938 . . . . 70.01 108.468 176.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . 0.462 ' HG2' ' OD1' ' A' ' 223' ' ' ASP . 57.6 tttm -122.04 -73.66 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 120.64 -0.424 . . . . 70.42 111.798 -176.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . 0.462 ' OD1' ' HG2' ' A' ' 222' ' ' LYS . 5.4 p-10 . . . . . 0 CA--C 1.481 -1.683 0 N-CA-C 103.753 -2.684 . . . . 43.01 103.753 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.434 -1.246 0 N-CA-C 108.791 -0.818 . . . . 63.34 108.791 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.3 t -92.68 120.54 33.19 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.676 -1.231 . . . . 72.32 107.676 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.41 -176.72 34.34 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.737 -0.744 . . . . 44.43 111.741 -176.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.4 pt -99.56 101.34 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-O 122.079 0.942 . . . . 74.33 110.619 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -121.63 137.87 54.57 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 114.731 -1.122 . . . . 73.22 108.381 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -149.1 66.68 0.38 Allowed Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.052 -0.819 . . . . 44.12 111.052 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.8 t -93.26 107.74 19.5 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.793 -0.817 . . . . 60.14 108.793 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 88.4 m -139.77 106.63 5.4 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 109.235 -0.654 . . . . 71.41 109.235 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -80.37 96.4 6.67 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 115.957 -0.565 . . . . 73.34 110.274 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -91.31 109.81 21.09 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 106.618 -1.623 . . . . 64.02 106.618 176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.79 -29.1 70.34 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 115.059 1.503 . . . . 71.01 115.059 -168.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mptt 61.64 75.59 0.4 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.034 0.445 . . . . 55.14 110.961 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.471 ' H ' ' HD2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -86.43 129.13 34.97 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.284 -1.376 . . . . 73.32 107.284 174.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -84.16 -56.87 3.43 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 109.36 -0.607 . . . . 73.45 109.36 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.8 m 46.16 84.37 0.03 OUTLIER 'General case' 0 C--O 1.241 0.626 0 N-CA-C 114.82 1.415 . . . . 72.52 114.82 177.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 91.8 t -86.2 99.96 8.59 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 107.797 -1.186 . . . . 74.11 107.797 173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.1 t -78.05 97.77 2.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 122.062 0.934 . . . . 72.11 109.156 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -129.99 152.55 49.33 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 106.894 -1.521 . . . . 74.35 106.894 -176.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 147.1 70.71 0.01 OUTLIER Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 118.999 -1.572 . . . . 62.12 113.194 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -158.12 136.68 11.14 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.229 -1.026 . . . . 35.13 108.229 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.3 p -99.16 157.66 16.22 Favored 'General case' 0 C--N 1.286 -2.156 0 N-CA-C 109.412 -0.588 . . . . 72.1 109.412 178.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.7 m -74.48 99.56 3.6 Favored 'General case' 0 N--CA 1.428 -1.536 0 N-CA-C 108.114 -1.069 . . . . 43.22 108.114 175.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.8 m -91.15 22.33 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.342 1.068 . . . . 63.53 111.857 -174.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -141.06 138.96 33.97 Favored 'General case' 0 C--N 1.255 -3.511 0 CA-C-N 112.309 -2.223 . . . . 75.42 107.814 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 29' ' ' GLU . . . -100.0 171.62 7.72 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.647 -0.706 . . . . 55.14 109.447 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' A' ' 157' ' ' HIS . 59.0 m -91.61 178.51 5.91 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 116.282 -0.417 . . . . 71.22 110.228 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.421 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.8 mm? -58.44 -36.4 73.6 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.101 0.561 . . . . 63.21 111.518 -174.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 12.7 tmtt? -63.54 -51.83 63.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.63 -0.507 . . . . 53.53 109.63 -177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.509 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.6 mp0 -70.74 -24.48 62.63 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.274 -0.571 . . . . 71.43 111.089 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -68.32 -47.24 68.06 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 108.488 -0.93 . . . . 70.35 108.488 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.37 -37.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.376 -0.829 . . . . 71.34 109.488 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -65.36 -36.81 85.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.67 -0.695 . . . . 71.32 109.745 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.505 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 91.8 t90 -66.84 -39.98 87.79 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.847 0.859 . . . . 72.23 109.546 178.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -66.17 -42.88 88.31 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.36 -0.836 . . . . 64.24 109.033 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.42 85.15 Favored 'General case' 0 N--CA 1.435 -1.183 0 CA-C-N 115.522 -0.763 . . . . 73.45 110.882 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 33' ' ' TRP . 5.5 pt-20 -73.72 -21.91 60.07 Favored 'General case' 0 C--O 1.214 -0.797 0 C-N-CA 120.548 -0.461 . . . . 73.11 111.668 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -69.71 -34.54 74.04 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 108.371 -0.974 . . . . 71.12 108.371 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 76' ' ' LYS . 77.9 t80 -84.33 -31.42 24.83 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.62 -0.718 . . . . 74.24 111.724 175.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.3 t -97.12 23.94 6.84 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 112.602 0.593 . . . . 73.55 112.602 -174.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -144.53 140.68 28.99 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 108.405 -0.961 . . . . 24.13 108.405 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -102.62 138.18 39.86 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.314 -0.624 . . . . 72.32 109.314 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.19 62.59 6.82 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-O 122.429 1.109 . . . . 43.12 110.857 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.1 m -59.73 -29.13 67.93 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 113.945 -1.479 . . . . 75.33 111.086 -177.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -91.96 7.32 42.66 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.022 -0.535 . . . . 71.45 110.804 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -111.37 121.16 44.5 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.705 -1.22 . . . . 75.03 107.705 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -83.92 119.93 25.48 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.744 -0.836 . . . . 52.23 108.744 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.556 HG22 ' CZ2' ' A' ' 50' ' ' TRP . 29.4 p -122.01 119.82 32.57 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 120.901 0.381 . . . . 54.42 111.446 -172.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m -124.68 86.74 2.6 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 109.218 -0.66 . . . . 74.13 109.218 173.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.7 tttm 38.92 75.6 0.07 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.812 1.645 . . . . 43.23 112.856 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.556 ' CZ2' HG22 ' A' ' 47' ' ' THR . 49.3 m0 -61.66 139.46 58.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.4 -0.364 . . . . 61.44 111.035 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 54' ' ' GLU . 77.8 m-20 -83.91 63.12 7.38 Favored 'General case' 0 CA--C 1.5 -0.953 0 CA-C-O 122.482 1.134 . . . . 74.24 111.158 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 102' ' ' PRO . 3.8 m -82.38 -36.81 26.4 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.228 -1.351 . . . . 71.25 107.688 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.45 ' HA ' HG22 ' A' ' 56' ' ' VAL . 4.5 p-10 -66.25 -28.6 68.85 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 114.624 -1.171 . . . . 75.43 108.993 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 51' ' ' ASN . 13.4 tp10 -63.34 -50.01 71.66 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.591 -0.732 . . . . 75.23 110.213 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.554 ' O ' HD13 ' A' ' 59' ' ' LEU . 38.9 ttmt -66.84 -38.99 87.45 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.325 -0.55 . . . . 73.33 110.601 -178.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.45 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 35.8 m -77.05 -19.03 14.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 C-N-CA 119.404 -0.918 . . . . 62.31 112.271 -178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -71.63 -24.65 61.91 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 121.241 0.543 . . . . 64.44 109.554 172.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -83.5 -35.05 25.16 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.466 0.65 . . . . 64.03 110.097 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 55' ' ' LYS . 5.2 mp -75.47 -42.17 53.79 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.21 -0.905 . . . . 74.41 112.925 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 87.0 mt -142.5 9.94 1.83 Allowed 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.788 1.032 . . . . 62.53 113.788 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 54.84 -127.8 2.25 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 122.728 0.411 . . . . 55.42 110.994 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.42 ' O ' HG22 ' A' ' 65' ' ' VAL . 8.1 pt-20 -65.89 -18.86 65.63 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.82 1.248 . . . . 75.35 114.001 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 60' ' ' LEU . 63.3 mttp -71.37 -22.69 61.85 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 112.835 0.68 . . . . 74.1 112.835 -173.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.32 13.49 12.76 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 112.567 0.58 . . . . 72.21 112.567 -174.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 62' ' ' GLU . 24.8 m -58.97 112.96 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 121.873 0.844 . . . . 74.13 112.46 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.94 63.16 1.84 Allowed Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 108.859 -1.696 . . . . 74.11 108.859 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 HD21 ' A' ' 109' ' ' LEU . 11.1 tt -75.87 -29.38 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 CA-C-N 115.748 -0.226 . . . . 74.03 111.445 -174.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.456 ' O ' HD13 ' A' ' 72' ' ' LEU . 1.5 mp0 -59.03 -50.01 75.72 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 109.529 -0.545 . . . . 61.43 109.529 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.2 p -68.13 -34.63 76.72 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.086 -0.506 . . . . 73.14 110.955 -179.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.498 ' HA ' ' HE ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -62.72 -47.04 85.32 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.326 -0.62 . . . . 71.3 109.326 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.2 mt -64.19 -39.37 93.85 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 115.767 -0.651 . . . . 75.23 110.043 178.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.548 HD11 ' O ' ' A' ' 97' ' ' ALA . 7.0 mp -59.58 -43.47 93.63 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 123.396 0.435 . . . . 74.34 112.101 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.26 -40.18 86.2 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.89 0.376 . . . . 74.43 111.093 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -70.14 -42.09 79.1 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.864 -0.607 . . . . 72.0 110.076 178.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.12 -32.58 70.67 Favored 'General case' 0 C--O 1.192 -1.969 0 CA-C-N 115.981 -0.554 . . . . 73.22 110.441 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.465 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 38.4 ttpt -56.33 -50.46 71.42 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.022 0.929 . . . . 74.04 110.316 173.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -63.73 -41.85 97.99 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.582 -0.736 . . . . 73.04 109.91 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -69.45 -28.31 66.0 Favored 'General case' 0 C--O 1.208 -1.085 0 C-N-CA 119.822 -0.751 . . . . 63.5 112.616 178.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -66.11 -42.93 88.58 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.947 -0.76 . . . . 54.12 108.947 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.78 -43.01 94.57 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.325 0.583 . . . . 65.34 110.232 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 81' ' ' LEU . 3.5 mm? -73.7 -35.24 65.12 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 120.017 -0.673 . . . . 71.23 112.699 178.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -69.66 -33.08 72.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 109.505 -0.554 . . . . 74.21 109.505 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 89' ' ' VAL . 18.7 p -76.53 -25.73 54.45 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.723 0.638 . . . . 73.31 112.723 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 81' ' ' LEU . 11.1 p -87.86 -24.08 6.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.382 -0.527 . . . . 74.2 110.288 175.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.442 ' O ' HD13 ' A' ' 85' ' ' LEU . 3.5 tm? -91.56 -26.54 18.7 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 116.328 -0.396 . . . . 74.44 111.069 -178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 72.4 m -109.95 132.85 53.78 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 109.296 -0.631 . . . . 72.15 109.296 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 165' ' ' ASN . 14.5 t -79.02 138.96 38.25 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 116.414 -0.357 . . . . 65.25 110.844 -173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 82.87 6.62 88.24 Favored Glycine 0 N--CA 1.438 -1.17 0 CA-C-N 115.879 -0.6 . . . . 65.3 113.038 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' A' ' 83' ' ' SER . 93.0 t -95.11 131.25 42.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 N-CA-C 109.753 -0.462 . . . . 62.23 109.753 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -65.84 146.75 54.37 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.663 -0.698 . . . . 74.34 110.358 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.25 10.18 17.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.613 1.197 . . . . 55.41 108.939 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 24.2 m -134.24 94.34 18.05 Favored Pre-proline 0 N--CA 1.42 -1.966 0 N-CA-C 106.899 -1.519 . . . . 70.33 106.899 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.38 131.72 12.99 Favored 'Trans proline' 0 N--CA 1.444 -1.385 0 C-N-CA 121.822 1.681 . . . . 71.42 112.525 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.2 -6.53 20.89 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 108.477 -0.934 . . . . 72.15 108.477 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -132.39 99.41 4.66 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.49 -1.232 . . . . 74.44 108.679 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 38' ' ' TYR . 98.6 t -114.04 126.81 71.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.315 0 CA-C-N 115.945 -0.571 . . . . 53.5 110.226 175.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.548 ' O ' HD11 ' A' ' 72' ' ' LEU . . . -83.23 113.83 20.95 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 109.195 -0.668 . . . . 73.52 109.195 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.476 ' HA ' HD21 ' A' ' 72' ' ' LEU . 35.0 m-80 -91.11 5.38 49.18 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.304 0.573 . . . . 75.01 111.205 -176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.537 ' HG3' HG21 ' A' ' 47' ' ' THR . 41.0 mmt180 -127.69 117.99 22.99 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 116.245 -0.434 . . . . 71.32 110.585 -177.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 49.8 t -114.45 124.74 71.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 106.539 -1.652 . . . . 72.52 106.539 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.47 148.06 87.77 Favored Pre-proline 0 C--N 1.291 -1.943 0 C-N-CA 123.514 0.726 . . . . 72.0 111.968 -178.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.463 ' HA ' HG23 ' A' ' 52' ' ' THR . 52.7 Cg_exo -51.41 -32.97 44.66 Favored 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 124.019 3.146 . . . . 71.12 114.883 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.454 ' C ' ' HB3' ' A' ' 223' ' ' ASP . . . -84.59 -46.77 5.64 Favored Glycine 0 C--N 1.3 -1.427 0 C-N-CA 120.489 -0.863 . . . . 45.03 112.019 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 108' ' ' MET . 10.6 m-20 -61.52 -29.17 69.82 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.105 0.479 . . . . 72.11 110.247 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.578 ' O ' ' HG ' ' A' ' 109' ' ' LEU . . . -58.16 -36.39 72.96 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.324 -0.853 . . . . 71.0 110.719 178.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.61 -41.82 93.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.377 -0.601 . . . . 72.4 109.377 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.495 ' O ' HG23 ' A' ' 111' ' ' VAL . 69.7 m -68.98 -37.48 78.78 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.044 -0.525 . . . . 73.01 110.918 177.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.458 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 84.1 mmm -58.37 -42.69 87.54 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.163 -0.68 . . . . 75.14 109.163 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 105' ' ' ALA . 88.4 mt -67.94 -37.64 81.87 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.112 -0.949 . . . . 75.33 110.583 178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -62.36 -44.06 97.35 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.33 -0.248 . . . . 73.2 110.33 174.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 107' ' ' SER . 86.3 t -58.21 -45.01 88.99 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.313 0 O-C-N 123.563 0.54 . . . . 71.24 110.039 177.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 108' ' ' MET . 88.7 mt -57.48 -35.03 69.67 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.012 0.434 . . . . 70.32 111.473 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.9 t -70.22 -43.14 71.26 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 109.727 -0.472 . . . . 74.53 109.727 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.1 mt -65.43 -43.47 94.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 116.086 -0.507 . . . . 62.42 109.973 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 73.3 m -59.19 -43.86 92.19 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.678 -0.692 . . . . 73.01 111.188 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -68.93 -32.64 72.4 Favored 'General case' 0 C--O 1.245 0.827 0 C-N-CA 119.962 -0.695 . . . . 73.4 109.618 -178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -69.1 -41.0 78.03 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.389 -0.823 . . . . 73.05 111.228 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -73.81 -33.8 64.32 Favored 'General case' 0 C--O 1.204 -1.315 0 C-N-CA 120.126 -0.63 . . . . 70.45 110.901 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' THR . 95.2 mt -59.31 -48.12 82.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 120.823 0.344 . . . . 74.44 110.075 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . 0.406 ' HB3' HG21 ' A' ' 180' ' ' VAL . 11.0 p -69.12 -33.4 73.42 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 116.345 -0.389 . . . . 54.02 111.423 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.8 t -69.55 -44.1 71.62 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 109.581 -0.526 . . . . 55.55 109.581 177.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.5 tt -64.57 -44.26 91.29 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 108.309 -0.996 . . . . 71.31 108.309 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.65 -47.02 87.25 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 123.754 0.659 . . . . 73.24 109.454 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -71.0 -35.12 71.96 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.262 0.553 . . . . 53.4 110.661 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HG2' ' CD1' ' A' ' 153' ' ' TRP . 51.7 tptt -77.55 -33.98 53.96 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.719 -0.673 . . . . 74.03 110.734 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.535 ' HA ' ' NE1' ' A' ' 129' ' ' TRP . 14.8 tt -75.65 -29.4 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 108.845 -0.798 . . . . 74.43 108.845 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 30.5 t70 -63.55 -35.0 79.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.426 -0.807 . . . . 63.12 109.68 175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.36 -44.46 91.36 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.183 -0.917 . . . . 64.13 110.556 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.535 ' NE1' ' HA ' ' A' ' 126' ' ' ILE 0.41 1.1 p90 -80.28 -19.22 47.2 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 114.36 1.245 . . . . 75.3 114.36 174.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 127' ' ' ASP . 27.5 ttpp -67.43 -27.26 66.91 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 73.4 109.353 171.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 131' ' ' LYS . 6.4 mmpt? -69.87 -26.11 64.04 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.709 -0.678 . . . . 71.22 109.375 174.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.9 t -80.04 115.79 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 CA-C-O 122.387 1.089 . . . . 74.15 110.765 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.62 ' HA ' HG12 ' A' ' 141' ' ' VAL . 20.8 ptmt -113.75 -164.43 0.93 Allowed 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 106.618 -1.623 . . . . 61.42 106.618 177.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.549 ' HA ' ' O ' ' A' ' 139' ' ' THR . . . -66.37 102.03 0.82 Allowed 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.937 -1.505 . . . . 70.33 106.937 172.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 69.8 p -87.97 -176.79 5.58 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.548 -0.751 . . . . 75.2 111.295 -173.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.13 -17.17 61.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.464 0.65 . . . . 74.54 111.33 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -77.42 -21.12 53.55 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.99 0.9 . . . . 74.42 109.185 174.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 91.31 21.7 34.31 Favored Glycine 0 N--CA 1.426 -2.023 0 CA-C-N 114.913 -1.039 . . . . 73.44 110.975 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 134' ' ' ALA . 18.4 m -67.88 135.89 53.19 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 124.095 0.527 . . . . 64.53 109.578 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -71.41 145.2 49.47 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.486 -0.931 . . . . 72.31 108.486 175.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 133' ' ' LYS . 5.8 m -68.37 142.7 15.99 Favored 'Isoleucine or valine' 0 C--O 1.25 1.117 0 N-CA-C 107.465 -1.309 . . . . 45.22 107.465 178.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.483 ' O ' HD13 ' A' ' 169' ' ' LEU . 2.0 mp -74.36 95.97 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 N-CA-C 108.882 -0.785 . . . . 70.41 108.882 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.409 ' HA ' HD22 ' A' ' 169' ' ' LEU . 98.8 mt-30 -85.06 -36.81 20.97 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.055 -0.52 . . . . 70.51 112.174 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -125.89 162.35 25.37 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 116.093 -0.503 . . . . 74.45 111.076 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.449 HG22 ' H ' ' A' ' 167' ' ' VAL . 11.1 tt -63.45 -26.69 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.279 -0.873 . . . . 31.31 110.244 177.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -80.89 24.65 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 CA-C-N 115.39 -0.823 . . . . 71.3 112.668 -175.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.487 ' HB3' ' OG1' ' A' ' 150' ' ' THR . 12.6 t70 -84.33 147.85 26.96 Favored 'General case' 0 N--CA 1.421 -1.878 0 N-CA-C 106.973 -1.492 . . . . 41.42 106.973 176.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.62 -33.14 67.92 Favored 'General case' 0 C--N 1.284 -2.277 0 C-N-CA 124.048 0.939 . . . . 65.55 113.234 -173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -87.26 -31.97 19.98 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 118.411 -1.316 . . . . 74.14 110.25 -177.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.487 ' OG1' ' HB3' ' A' ' 147' ' ' ASP . 1.0 OUTLIER -66.34 -41.92 88.88 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.318 -0.993 . . . . 75.32 108.318 175.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.445 ' O ' HG22 ' A' ' 155' ' ' VAL . 88.5 m-20 -62.87 -32.46 73.71 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-N 115.234 -0.893 . . . . 63.42 110.031 176.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 88.9 m -60.63 -40.8 93.29 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 123.174 0.296 . . . . 74.5 110.85 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.477 ' CD1' ' HG2' ' A' ' 125' ' ' LYS . 79.4 t90 -73.23 -41.1 64.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 N-CA-C 109.255 -0.646 . . . . 64.12 109.255 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.431 ' HD1' ' O ' ' A' ' 150' ' ' THR . 40.0 m-85 -63.56 -47.49 81.32 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.291 -0.868 . . . . 74.02 112.514 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 151' ' ' ASN . 29.5 m -65.28 -35.59 75.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 122.046 -0.409 . . . . 72.55 112.006 179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.31 -33.71 76.46 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.251 -0.431 . . . . 50.12 110.879 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.404 ' O ' ' HB3' ' A' ' 26' ' ' SER . 9.2 m-70 -85.84 -3.84 59.01 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.91 1.078 . . . . 75.41 113.91 178.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 111.86 -4.29 27.4 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 119.372 -1.394 . . . . 45.12 113.63 176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 154' ' ' PHE . 57.3 m-85 -79.27 106.69 11.48 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 117.229 0.515 . . . . 75.23 111.42 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . 0.538 ' HB3' ' HG2' ' A' ' 163' ' ' GLU . 30.9 ttmt -66.28 135.28 54.2 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.412 -1.699 . . . . 73.23 106.412 172.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 33.4 t -64.26 -27.3 42.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.646 0.736 . . . . 73.41 110.216 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.18 60.32 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.603 -0.726 . . . . 75.12 112.137 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.538 ' HG2' ' HB3' ' A' ' 160' ' ' LYS . 65.9 mm-40 -89.07 -38.51 14.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.885 0.374 . . . . 74.01 110.242 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.44 148.8 38.81 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.7 0.762 . . . . 62.24 112.217 -175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ASN . . . . . 0.451 ' HB2' ' N ' ' A' ' 87' ' ' THR . 62.5 t30 -105.34 137.25 43.45 Favored 'General case' 0 C--N 1.284 -2.239 0 N-CA-C 107.711 -1.218 . . . . 75.41 107.711 -176.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.3 141.26 54.35 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.133 0.492 . . . . 74.22 112.303 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.449 ' H ' HG22 ' A' ' 145' ' ' ILE . 11.3 p -158.3 153.62 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.534 0 N-CA-C 107.535 -1.283 . . . . 71.13 107.535 -176.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 28.6 p -76.45 153.77 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.511 0.324 . . . . 72.2 110.536 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 142' ' ' ILE . 2.0 pt? -62.79 -31.46 72.43 Favored 'General case' 0 C--O 1.21 -1.015 0 N-CA-C 108.733 -0.84 . . . . 75.43 108.733 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -71.35 -36.35 71.49 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.256 -0.883 . . . . 74.34 110.98 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -78.94 -41.01 30.44 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 118.742 -1.183 . . . . 72.32 109.37 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.66 -43.02 94.96 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.772 -0.649 . . . . 73.52 111.226 -177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.13 76.36 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 44.4 110.909 -178.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.7 m -74.89 -36.64 62.23 Favored 'General case' 0 N--CA 1.42 -1.972 0 C-N-CA 120.514 -0.475 . . . . 74.44 110.894 -177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.1 p -78.17 -32.99 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 C-N-CA 119.39 -0.924 . . . . 62.12 111.066 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.87 -32.47 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 C-N-CA 119.555 -0.858 . . . . 71.24 109.006 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ASN . . . . . 0.46 ' HA ' HG12 ' A' ' 180' ' ' VAL . 54.2 t30 -67.14 -35.33 79.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.615 -0.72 . . . . 71.54 109.44 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -67.85 -39.95 83.74 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.434 -0.803 . . . . 52.14 110.633 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.02 -32.96 61.72 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 112.532 0.567 . . . . 51.31 112.532 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' VAL . . . . . 0.46 HG12 ' HA ' ' A' ' 177' ' ' ASN . 14.7 p -77.63 -22.25 14.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 120.183 -0.607 . . . . 74.24 110.429 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 14.9 m -105.7 16.33 25.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 116.231 -0.44 . . . . 72.53 110.008 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 184' ' ' ASP . 62.0 t-80 -73.65 114.0 11.42 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.466 -0.939 . . . . 70.41 108.466 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -58.19 -38.76 77.35 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.36 0.874 . . . . 64.51 113.36 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 182' ' ' HIS . 15.8 t70 -77.53 -34.67 53.89 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.746 0.646 . . . . 74.25 112.746 -176.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.48 -43.17 50.72 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 109.669 -0.493 . . . . 71.4 109.669 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . . . . . . . . . 16.5 tt -72.02 -24.14 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 C-N-CA 120.262 -0.575 . . . . 75.3 110.917 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -68.39 -41.44 80.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 120.042 -0.663 . . . . 73.44 110.411 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' ILE . . . . . 0.591 HG12 ' SD ' ' A' ' 192' ' ' MET . 13.9 tt -73.45 -29.63 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 118.702 -1.199 . . . . 62.13 108.348 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.44 -37.81 88.71 Favored 'General case' 0 C--O 1.215 -0.711 0 CA-C-N 116.024 -0.535 . . . . 71.32 110.647 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.29 -43.71 98.19 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.053 0.541 . . . . 74.34 110.005 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -63.2 -43.32 98.5 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.772 -0.649 . . . . 74.34 109.527 175.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' MET . . . . . 0.591 ' SD ' HG12 ' A' ' 188' ' ' ILE . 0.0 OUTLIER -60.55 -41.7 95.04 Favored 'General case' 0 C--O 1.196 -1.755 0 CA-C-N 115.829 -0.623 . . . . 54.12 111.201 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -59.51 -37.17 77.61 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 112.846 0.684 . . . . 61.55 112.846 178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -78.0 -36.29 49.0 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 117.404 -1.718 . . . . 75.44 110.598 174.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -64.08 -48.1 77.51 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.954 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 35.7 m -65.81 -28.15 43.22 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.773 0 CA-C-O 120.619 0.247 . . . . 73.42 110.648 -176.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -68.77 -45.51 71.2 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.92 -0.582 . . . . 75.13 109.734 177.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -71.88 -33.53 68.43 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 112.585 0.587 . . . . 75.42 112.585 177.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' TRP . . . . . 0.456 ' O ' ' HG3' ' A' ' 203' ' ' GLU . 35.5 m0 -66.55 -47.01 74.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.399 -0.222 . . . . 54.32 110.399 175.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 83.0 m -64.65 -38.59 91.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 110.012 -0.366 . . . . 61.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -63.87 -46.36 85.32 Favored 'General case' 0 C--O 1.201 -1.468 0 CA-C-N 116.14 -0.482 . . . . 75.43 110.426 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.35 -39.22 93.46 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 123.117 0.261 . . . . 70.1 110.859 -177.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 199' ' ' TRP . 38.7 mt-10 -66.02 -44.47 84.63 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 120.585 -0.446 . . . . 75.23 110.168 178.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . . . . . . . . . 19.4 m -69.82 -35.46 74.81 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.311 0.577 . . . . 72.01 110.277 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -67.16 -46.27 74.53 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 108.572 -0.899 . . . . 75.5 108.572 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -61.93 -42.46 99.13 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 115.237 -0.892 . . . . 75.44 110.943 -178.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 4.1 pp -72.82 -31.28 64.69 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 119.666 -0.813 . . . . 72.13 111.749 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.68 49.59 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 121.194 -0.202 . . . . 63.55 110.787 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' MET . . . . . . . . . . . . . 60.0 ttp -65.36 -43.67 90.11 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.304 0.573 . . . . 55.3 109.463 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' MET . . . . . . . . . . . . . 48.0 ttm -69.15 -30.31 68.52 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.472 -0.785 . . . . 54.13 110.65 -178.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' ALA . . . . . . . . . . . . . . . -68.87 -34.69 75.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.76 0.314 . . . . 35.34 110.656 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.04 -39.13 75.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.818 0.818 . . . . 71.33 108.81 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -63.05 -41.22 99.43 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.029 -1.441 . . . . 65.13 110.167 175.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' GLY . . . . . . . . . . . . . . . 139.93 -92.3 0.19 Allowed Glycine 0 N--CA 1.424 -2.116 0 N-CA-C 107.111 -2.396 . . . . 74.21 107.111 -176.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' ILE . . . . . . . . . . . . . 16.4 tt -173.13 120.75 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 CA-C-O 121.296 0.57 . . . . 65.02 110.582 172.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' SER . . . . . . . . . . . . . 47.2 t -91.82 -49.71 6.11 Favored 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 107.126 -1.435 . . . . 61.54 107.126 174.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' GLY . . . . . . . . . . . . . . . 75.57 81.02 0.54 Allowed Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 111.146 -0.782 . . . . 74.54 111.146 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' ALA . . . . . . . . . . . . . . . -117.16 146.66 43.05 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.679 -0.489 . . . . 63.13 109.679 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -148.97 122.44 9.1 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.297 -1.372 . . . . 74.1 107.297 -177.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' GLY . . . . . . . . . . . . . . . -106.36 72.51 0.22 Allowed Glycine 0 C--N 1.302 -1.349 0 C-N-CA 120.147 -1.025 . . . . 43.35 112.433 -175.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 221' ' ' LYS . . . . . . . . . . . . . 62.8 tttp 69.75 -65.54 0.3 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.896 1.278 . . . . 73.44 110.873 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp 174.4 -63.73 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 105.958 -1.868 . . . . 61.12 105.958 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 223' ' ' ASP . . . . . 0.454 ' HB3' ' C ' ' A' ' 103' ' ' GLY . 11.7 m-20 . . . . . 0 C--N 1.301 -1.51 0 N-CA-C 107.361 -1.348 . . . . 62.11 107.361 -179.744 . . . . . . . . 1 1 . 1 stop_ save_