data_2nd9_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 2nd9 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.453 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 78.7 t . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 112.908 0.707 . . . . 1.65 112.908 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.503 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.14 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 1.05 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.564 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 1.26 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.679 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.87 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 1.04 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD12 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.669 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.52 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.586 HG22 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 1.01 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.494 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.95 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.494 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 14.5 m120 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.81 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.405 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 1.28 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 1.01 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.588 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 1.04 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.55 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 1.02 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.521 ' HG2' HG21 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 2.38 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.685 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.81 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.554 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.2 mm100 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.88 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.528 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.17 112.003 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HD2' HD11 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 2.11 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.623 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 1.03 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.76 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.642 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 1.02 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 1.44 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.643 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.99 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 1.05 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 1.0 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 2.42 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.788 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 1.01 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.63 109.136 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.67 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.656 ' NE2' HD11 ' A' ' 59' ' ' LEU . 33.1 t-80 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.19 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 1.09 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.777 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 1.05 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.496 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 1.05 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.712 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.97 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.87 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.65 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 1.03 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.609 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.68 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.732 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 1.01 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.734 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.97 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 1.04 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.587 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.3 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.623 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 1.02 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.734 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 1.59 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.641 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 1.0 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.643 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.421 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 1.02 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.643 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 1.04 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.705 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.672 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.658 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.537 ' HZ2' ' HB2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 3.37 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.662 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.17 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.99 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.641 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 1.03 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.685 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 1.04 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.586 ' C ' HG22 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.588 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 1.03 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.57 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 1.02 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 1.01 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 1.31 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 1.02 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.658 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 2.48 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.401 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 1.03 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.598 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 1.06 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.92 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 109' ' ' LYS . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.705 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.98 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.522 ' HZ1' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.78 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.65 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 1.05 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 1.03 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.464 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 2.41 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.587 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.9 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 1.06 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.782 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 1.03 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.9 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 1.03 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 1.02 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.581 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 2.23 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.672 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 1.02 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.65 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.99 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.99 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.631 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 1.02 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.401 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 77.6 t . . . . . 0 N--CA 1.442 -0.844 0 N-CA-C 112.871 0.693 . . . . 1.65 112.871 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.531 ' HA ' HD11 ' A' ' 58' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.14 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.583 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 1.05 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.577 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 1.26 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.58 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.87 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 1.04 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.712 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.651 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.52 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.616 HG23 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 1.01 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.449 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 5.6 p-10 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.95 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.449 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.81 108.822 169.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.427 ' HG2' ' CD2' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 1.28 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.412 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 1.01 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.588 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 1.04 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.556 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 1.02 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 2.38 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.902 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.81 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 12.5 mm100 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.88 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.54 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.17 111.125 -178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 2.11 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 1.03 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.76 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.62 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.495 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 1.02 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.677 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 1.44 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.645 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.99 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.79 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 1.05 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.63 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 1.0 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.692 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 2.42 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 1.01 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.692 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.63 109.501 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.67 111.899 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.65 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 36.1 t-80 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.19 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 1.09 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 1.05 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.485 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 1.05 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.707 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.97 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.87 109.771 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.65 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.677 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 1.03 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.707 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.58 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.68 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.712 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 1.01 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.97 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 1.04 110.645 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.599 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 37.5 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.6 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 1.02 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.729 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 1.59 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 1.0 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.612 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 1.0 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.682 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.44 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.635 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 1.02 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.682 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 1.04 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.667 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.728 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.693 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 3.37 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.17 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.525 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.99 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.612 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 1.03 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.902 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 1.04 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.616 ' C ' HG23 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.588 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 1.03 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.582 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 1.02 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.646 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 1.01 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 1.31 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 1.02 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.693 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 2.48 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 1.03 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.592 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 1.06 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.92 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 109' ' ' LYS . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.667 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.98 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.78 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.726 ' CG ' HG21 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 1.05 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 1.03 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.8 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 2.41 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.599 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.9 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.459 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 1.06 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.78 ' O ' HG22 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.751 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 1.03 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.8 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.9 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 1.03 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.751 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 1.02 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 2.23 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 1.02 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.726 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.99 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.99 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 1.02 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 55.4 t . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.624 0.601 . . . . 1.65 112.624 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 58' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.14 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.433 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 1.05 111.178 -175.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.632 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 1.26 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.87 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 1.04 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CG ' HD12 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.667 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.52 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.644 HG23 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 1.01 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.95 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.81 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 1.28 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.403 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 1.01 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.597 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 1.04 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.558 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 1.02 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 2.38 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.88 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.81 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.536 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.6 mm100 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.88 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.535 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.17 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.531 ' CD ' HD12 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 2.11 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 1.03 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.76 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.622 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 1.02 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 1.44 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.66 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.99 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.792 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 1.05 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 1.0 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.707 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 2.42 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.792 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 1.01 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.707 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.63 109.587 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.512 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.67 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.621 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.4 t-80 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.19 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 1.09 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.787 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 1.05 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.451 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 1.05 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.719 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.97 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.87 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.787 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.65 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 1.03 110.933 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.571 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.68 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.72 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 1.01 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.723 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.97 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.404 HG21 HG23 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 1.04 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.592 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.7 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.606 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 1.02 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 1.59 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 1.0 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.636 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 1.0 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.758 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.7 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.618 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 1.02 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.681 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB1' ' O ' ' A' ' 86' ' ' GLN . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 1.04 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.757 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 3.37 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.681 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.17 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.99 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.636 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 1.03 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.88 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 1.04 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.644 ' C ' HG23 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.597 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 1.03 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.589 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 1.02 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.451 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 1.01 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 1.31 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.412 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 1.02 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 2.48 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.496 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 1.03 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.605 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 1.06 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.92 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.757 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.98 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.78 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.697 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 1.05 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.415 HG22 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 1.03 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 2.41 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.592 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.9 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.513 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 1.06 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG21 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 1.03 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.514 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.9 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.809 HG21 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 1.03 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 1.02 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.589 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 2.23 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 1.02 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.697 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.99 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.99 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 1.02 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.496 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.512 ' CG2' ' HG3' ' A' ' 67' ' ' GLU . 92.9 t . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 112.407 0.521 . . . . 1.65 112.407 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.576 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.14 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.571 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 1.05 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.577 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 1.26 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.576 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.87 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 1.04 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.719 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.633 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.52 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.629 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 1.01 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.95 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.81 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.428 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 1.28 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 1.01 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.576 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 1.04 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.565 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 1.02 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 2.38 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.81 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.52 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.3 mm100 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.88 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.532 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.17 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.551 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 2.11 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.621 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 1.03 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.76 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 1.02 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.616 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 1.44 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.684 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.99 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 1.05 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 1.0 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.662 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 2.42 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 1.01 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.662 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.63 109.061 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.67 111.438 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HG3' ' CG2' ' A' ' 25' ' ' VAL . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.629 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 27.7 t-80 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.19 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 1.09 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.754 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 1.05 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.486 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 1.05 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.97 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.87 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.754 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.65 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 1.03 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.68 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.719 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 1.01 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.725 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.97 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 1.04 110.504 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.581 ' HB3' HD21 ' A' ' 124' ' ' LEU . 40.5 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.621 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 1.02 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.725 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 1.59 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 1.0 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.641 HG22 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 1.0 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.708 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.406 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 1.02 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.687 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.708 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 1.04 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.67 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.689 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 3.37 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.17 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.525 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.99 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.641 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 1.03 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.707 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 1.04 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.629 ' C ' HG22 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.576 ' HA3' ' HB3' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 1.03 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 1.02 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.506 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.641 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 1.01 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . 0.424 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 1.31 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 1.02 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.689 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 2.48 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.488 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 1.03 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.621 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 1.06 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.92 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.98 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.78 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.687 ' CG ' HG22 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 1.05 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.43 HG21 ' HB1' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 1.03 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 2.41 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.57 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.9 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 1.06 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.798 ' O ' HG21 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 1.03 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.496 ' HA ' HD11 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.9 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.798 HG21 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 1.03 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 1.02 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 2.23 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.67 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 1.02 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.687 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.99 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.99 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.641 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 1.02 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.488 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.436 HG13 ' ND2' ' A' ' 29' ' ' ASN . 55.3 t . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 112.977 0.732 . . . . 1.65 112.977 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.607 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.14 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.575 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 1.05 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.723 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 1.26 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.575 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.87 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 1.04 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.719 ' CG ' HD12 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.637 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.52 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.656 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 1.01 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.95 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.81 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 1.28 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.524 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 1.01 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.576 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 1.04 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.547 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 1.02 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.403 ' O ' ' CE2' ' A' ' 49' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 2.38 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.81 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.649 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.88 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.487 ' CE2' HG21 ' A' ' 82' ' ' ILE . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.17 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.57 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 2.11 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.612 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 1.03 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.76 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.656 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.482 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 1.02 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.594 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 1.44 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.99 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.808 ' O ' HD21 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 1.05 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.588 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 1.0 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.814 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 2.42 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.808 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 1.01 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.814 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.63 109.037 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.67 112.095 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.9 t-80 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.19 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 1.09 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.762 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 1.05 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.508 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 1.05 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.66 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.97 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.87 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.762 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.65 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.594 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 1.03 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.66 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.68 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.719 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 1.01 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.733 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.97 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 1.04 110.586 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD21 ' A' ' 124' ' ' LEU . 38.7 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.612 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 1.02 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.733 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 1.59 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.662 HG22 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 1.0 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.725 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.607 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 1.02 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.679 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.725 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 1.04 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.705 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 3.37 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.17 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.99 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.662 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 1.03 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 1.04 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.656 ' C ' HG22 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.576 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 1.03 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 1.02 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.5 ' H ' HD11 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.639 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 1.01 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 1.31 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 1.02 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.667 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 2.48 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.51 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 1.03 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.622 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 1.06 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.92 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.705 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.98 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.78 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 1.05 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.49 HG22 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 1.03 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 2.41 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.535 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.9 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.524 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.812 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 1.06 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.76 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.722 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 1.03 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.624 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.9 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 1.03 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 1.02 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 2.23 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 1.02 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.674 HG21 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.99 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.99 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.639 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 1.02 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.51 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.453 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 50.7 t . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 113.041 0.756 . . . . 1.65 113.041 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.579 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.14 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.627 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 1.05 110.91 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.606 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 1.26 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.594 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.87 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 1.04 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.652 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.52 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 1.01 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.552 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.95 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.552 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.81 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 36' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 1.28 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.484 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 1.01 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.568 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 1.04 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.561 HD22 ' CG2' ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 1.02 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 2.38 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.845 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.81 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.524 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.4 mm100 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.88 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.61 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.17 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.574 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 2.11 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 1.03 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.76 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.628 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 1.02 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.604 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 1.44 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.66 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.99 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.789 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 1.05 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.596 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 1.0 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 2.42 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 1.01 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.63 109.288 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.67 111.806 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' A' ' 25' ' ' VAL . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.617 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.19 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 1.09 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 1.05 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.501 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 1.05 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.97 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.87 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.65 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 1.03 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.68 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 1.01 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.713 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.97 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 1.04 110.619 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.585 ' HB3' HD22 ' A' ' 124' ' ' LEU . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.619 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 1.02 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.713 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 1.59 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 1.0 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.622 HG21 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 1.0 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.61 ' NE2' ' HD1' ' A' ' 49' ' ' PHE . 1.7 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 1.02 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 1.04 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.692 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.663 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.665 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 3.37 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.17 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.536 ' HB1' HD11 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.99 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.622 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 1.03 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.845 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 1.04 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.695 ' C ' HG23 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.568 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 1.03 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 1.02 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.453 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.646 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 1.01 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 1.31 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.452 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 1.02 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.665 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 2.48 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 1.03 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.595 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 1.06 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.92 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.692 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.98 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.78 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 1.05 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.437 HG23 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 1.03 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 2.41 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.552 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.9 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.781 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 1.06 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.734 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 1.03 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD11 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.9 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.787 HG22 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 1.03 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 1.02 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.59 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 2.23 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.663 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 1.02 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.705 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.99 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.99 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.646 HD23 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 1.02 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.435 ' CG2' ' HG3' ' A' ' 67' ' ' GLU . 66.9 t . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 113.154 0.798 . . . . 1.65 113.154 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HA ' HD11 ' A' ' 58' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.14 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.561 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.414 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 1.05 111.015 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.588 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 1.26 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.87 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 1.04 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.712 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.633 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.52 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.629 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 1.01 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.571 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.95 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.571 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.81 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 1.28 110.532 174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.435 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 1.01 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.602 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 1.04 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.566 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 1.02 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 2.38 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.892 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.81 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.54 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.3 mm100 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.88 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.504 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.17 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 2.11 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 1.03 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.76 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.621 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.495 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 1.02 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.64 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 1.44 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.678 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.99 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.795 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 1.05 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.543 HD23 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 1.0 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.7 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 2.42 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.795 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 1.01 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.7 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.63 109.125 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.67 112.191 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.435 ' HG3' ' CG2' ' A' ' 25' ' ' VAL . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.652 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.2 t-80 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.19 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 1.09 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 1.05 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.499 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 1.05 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.97 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.87 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.65 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.64 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 1.03 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.715 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.68 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.712 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 1.01 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.716 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.97 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.402 HG23 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 1.04 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.578 ' HB3' HD22 ' A' ' 124' ' ' LEU . 40.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.624 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 1.02 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.716 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 1.59 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 1.0 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.632 HG22 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 1.0 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.781 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 1.02 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.705 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 1.04 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.682 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 3.37 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.705 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.17 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.55 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.99 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.632 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 1.03 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.892 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 1.04 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.629 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.602 ' HA3' ' HB3' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 1.03 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.574 HD23 HD12 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 1.02 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.635 ' HA ' HD23 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 1.01 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 1.31 109.272 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.545 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 1.02 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.545 ' HD3' ' HA ' ' A' ' 106' ' ' ALA . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 2.48 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 1.03 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.627 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 1.06 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.92 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.682 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.98 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.78 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 1.05 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.427 HG23 ' HB2' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 1.03 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 2.41 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.57 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.9 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 1.06 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.81 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.754 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 1.03 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.513 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.9 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 1.03 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 1.02 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 2.23 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.677 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 1.02 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.695 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.99 110.264 -177.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.635 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 1.02 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 54.8 t . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 113.003 0.742 . . . . 1.65 113.003 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 58' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.14 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.528 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 1.05 111.019 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.604 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 1.26 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.559 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.87 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 1.04 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.71 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.664 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.52 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.702 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 1.01 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.95 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.81 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.418 ' HA ' ' CG ' ' A' ' 36' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 1.28 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.536 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 1.01 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.564 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 1.04 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 1.02 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.525 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 2.38 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.908 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.81 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 8.7 mm100 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.88 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.548 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.17 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.56 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 2.11 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.603 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 1.03 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.76 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.648 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.504 HD11 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 1.02 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.532 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 1.44 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.661 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.99 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 1.05 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.657 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.733 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 2.42 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.781 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 1.01 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.733 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.63 109.447 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.67 112.017 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.426 ' HG3' ' CG2' ' A' ' 25' ' ' VAL . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.669 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 31.4 t-80 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.19 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 1.09 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 1.05 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.498 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 1.05 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.638 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.97 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.87 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.65 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.532 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 1.03 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.68 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.71 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 1.01 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.694 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.97 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 1.04 110.458 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD23 ' A' ' 124' ' ' LEU . 40.2 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.603 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 1.02 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.694 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 1.59 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 1.0 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.624 HG21 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 1.0 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.573 ' HG3' HD11 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.494 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 1.02 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 1.04 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.674 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 3.37 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.17 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.541 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.99 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.624 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 1.03 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.908 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 1.04 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.702 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.564 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 1.03 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.577 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 1.02 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.475 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.636 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 1.01 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 1.31 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 1.02 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.674 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 2.48 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.557 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 1.03 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.658 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 1.06 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.92 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.418 ' H ' ' C ' ' A' ' 109' ' ' LYS . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.98 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.78 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 1.05 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.432 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 1.03 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 2.41 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.558 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.9 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.8 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 1.06 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.775 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.771 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 1.03 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.509 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.8 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.9 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 1.03 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 1.02 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.596 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 2.23 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.686 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 1.02 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.99 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.99 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 1.02 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.557 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.476 HG11 ' HG3' ' A' ' 67' ' ' GLU . 1.6 m . . . . . 0 N--CA 1.439 -1.012 0 N-CA-C 113.476 0.917 . . . . 1.65 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HA ' HD13 ' A' ' 58' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.14 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.63 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 1.05 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.606 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 1.26 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.582 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.87 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 1.04 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.596 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.52 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.614 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 1.01 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.569 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.95 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.569 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.81 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 1.28 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 1.01 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.589 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 1.04 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.561 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 1.02 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 2.38 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.896 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.81 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.88 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' A' ' 82' ' ' ILE . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.17 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 2.11 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 1.03 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.76 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.606 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.516 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 1.02 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.605 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 1.44 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.673 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.99 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.79 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 1.05 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.552 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 1.0 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.688 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 2.42 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 1.01 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.688 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.63 109.55 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.67 111.864 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.476 ' HG3' HG11 ' A' ' 25' ' ' VAL . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.19 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 1.09 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.826 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 1.05 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.488 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 1.05 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.97 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.87 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.65 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.405 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 1.03 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.611 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.68 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.723 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 1.01 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.707 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.97 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 1.04 110.743 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.58 ' HB3' HD21 ' A' ' 124' ' ' LEU . 38.5 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.614 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 1.02 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.707 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 1.59 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 1.0 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.625 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 1.0 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.583 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 1.02 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 1.04 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.706 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.675 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.687 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 3.37 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.17 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.99 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.625 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 1.03 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.896 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 1.04 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.614 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.589 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 1.03 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.572 HD22 HD13 ' A' ' 134' ' ' LEU . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 1.02 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.472 ' H ' HD11 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 1.01 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 1.31 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 1.02 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 2.48 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 1.03 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 1.06 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.92 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.706 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.98 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.78 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG21 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 1.05 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.44 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 1.03 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 2.41 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.564 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.9 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.85 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 1.06 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG21 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.747 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 1.03 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.509 ' HA ' HD13 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.85 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.9 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.792 HG21 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 1.03 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.747 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 1.02 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.568 ' C ' HD21 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 2.23 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.675 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 1.02 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.688 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.99 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.99 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 1.02 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.451 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 78.7 t . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 112.928 0.714 . . . . 1.65 112.928 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.551 ' CE1' HD12 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.14 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.615 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.415 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 1.05 111.156 -176.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.615 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 1.26 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.87 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 1.04 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.637 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.52 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.671 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 1.01 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.95 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.81 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.415 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 1.28 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.47 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 1.01 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.629 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 1.04 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.561 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 1.02 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HG2' HG21 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 2.38 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.4 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.81 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.542 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.88 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.512 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.17 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.56 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 2.11 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 1.03 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.76 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.642 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 1.02 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 1.44 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.688 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.99 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.803 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 1.05 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 1.0 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.766 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 2.42 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.803 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 1.01 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.766 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.63 109.704 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.67 110.246 177.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.689 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 26.8 t-80 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.19 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 1.09 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 1.05 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.499 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 1.05 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.97 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.87 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.65 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 1.03 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.68 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 1.01 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.97 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 1.04 110.555 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.583 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.7 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 1.02 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.72 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 1.59 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 1.0 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.567 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 1.02 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 1.04 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 3.37 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.17 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.541 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.99 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.615 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 1.03 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 1.04 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.671 ' C ' HG22 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.629 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 1.03 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.574 HD21 HD12 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 1.02 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.567 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.654 ' HA ' HD23 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 1.01 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . 0.446 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 1.31 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.567 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 1.02 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.69 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 2.48 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.524 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 1.03 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.579 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 1.06 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.92 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.98 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.78 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.687 ' CG ' HG21 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 1.05 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.465 HG22 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 1.03 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 2.41 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.583 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.9 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.558 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 1.06 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.807 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.768 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 1.03 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.9 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 1.03 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.768 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 1.02 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.576 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 2.23 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 1.02 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.687 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.99 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.99 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 1.02 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.524 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG11 ' ND2' ' A' ' 29' ' ' ASN . 59.1 t . . . . . 0 N--CA 1.439 -1.01 0 N-CA-C 112.776 0.658 . . . . 1.65 112.776 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.606 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.14 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.527 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 1.05 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 1.26 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.703 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.87 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.488 ' CG ' ' HZ1' ' A' ' 41' ' ' LYS . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.577 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 1.04 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.666 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.52 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.68 HG23 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 1.01 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.554 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.95 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.81 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.579 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 1.28 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 1.01 109.466 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.694 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 1.04 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.566 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 1.02 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 2.38 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.886 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.81 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.3 mm100 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.88 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.17 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.576 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 2.11 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.616 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 1.03 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.76 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.627 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 1.02 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.667 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.629 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.99 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.777 ' O ' HD21 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 1.05 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.658 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 1.0 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.695 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 2.42 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 1.01 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.695 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.63 109.863 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.67 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.415 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.668 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 35.7 t-80 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.19 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 1.09 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.789 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 1.05 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.507 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 1.05 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.97 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.87 109.61 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.789 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.65 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.667 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 1.03 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.622 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.68 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 1.01 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.702 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.97 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 1.04 110.523 178.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.579 ' HB3' HD22 ' A' ' 124' ' ' LEU . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.616 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 1.02 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 1.59 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.612 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 1.0 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.62 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 1.0 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.599 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 1.02 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 87' ' ' ASP . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 1.04 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.668 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 3.37 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.17 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.54 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.99 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 1.03 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.886 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 1.04 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.68 ' C ' HG23 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.694 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 1.03 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.579 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 1.02 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.527 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.632 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 1.01 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 1.31 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.527 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 1.02 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 2.48 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.437 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 1.03 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 1.06 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.92 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.98 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.78 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.692 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 1.05 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.492 HG22 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 1.03 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 2.41 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.547 ' HB ' ' HG3' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.9 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.534 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 1.06 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.793 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 1.03 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.9 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.8 HG22 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 1.03 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 1.02 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.584 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 2.23 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.668 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 1.02 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.692 HG21 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.99 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.99 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.632 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 1.02 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.437 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.511 ' CG2' ' HG3' ' A' ' 67' ' ' GLU . 55.5 t . . . . . 0 N--CA 1.422 -1.827 0 CA-C-O 121.217 0.532 . . . . 1.65 110.86 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.507 ' CE1' HD12 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.14 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.662 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 1.05 110.911 -176.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.621 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 1.26 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.683 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.87 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 1.04 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.667 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.52 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.66 HG23 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 1.01 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.95 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.81 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 1.28 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.439 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 1.01 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.599 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 1.04 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.555 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 1.02 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 2.38 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.897 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.81 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.6 mm100 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.88 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.5 ' CE2' HG23 ' A' ' 82' ' ' ILE . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.17 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.559 ' CD ' HD13 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 2.11 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.607 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 1.03 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.76 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.654 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.507 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 1.02 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 1.44 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.675 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.99 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 1.05 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 1.0 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.692 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.675 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 2.42 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 1.01 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.692 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.63 109.432 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.67 110.636 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.511 ' HG3' ' CG2' ' A' ' 25' ' ' VAL . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.672 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 38.7 t-80 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.19 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 1.09 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 1.05 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.49 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 1.05 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.639 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.97 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.87 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.65 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 1.03 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.639 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.588 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.68 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 1.01 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.97 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 1.04 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.588 ' HB3' HD21 ' A' ' 124' ' ' LEU . 39.6 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.607 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 1.02 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 1.59 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.596 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 1.0 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.63 HG22 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 1.0 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.609 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.521 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 1.02 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.609 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 1.04 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.68 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.757 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.674 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 3.37 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.17 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.538 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.99 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.63 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 1.03 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.897 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 1.04 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.66 ' C ' HG23 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.599 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 1.03 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 1.02 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.653 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 1.01 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 1.31 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 1.02 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.674 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 2.48 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 1.03 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.65 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 1.06 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.92 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.68 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.98 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.78 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.701 ' CG ' HG21 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 1.05 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.462 HG23 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 1.03 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 2.41 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.548 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.9 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.528 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.841 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 1.06 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.779 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 1.03 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.5 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.841 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.9 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.779 HG22 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 1.03 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 1.02 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.594 ' C ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 2.23 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.757 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 1.02 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.701 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.99 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.99 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 1.02 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 113.251 0.834 . . . . 1.65 113.251 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.14 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.58 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 1.05 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 1.26 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.588 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.87 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 1.04 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.704 ' CG ' HD13 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.686 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.52 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.678 HG22 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 1.01 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.572 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.95 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.572 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.81 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.576 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 1.28 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.579 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 1.01 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 1.04 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 1.02 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HG2' HG21 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 2.38 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.81 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.619 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.88 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.569 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.17 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 2.11 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 1.03 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.76 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.634 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.503 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 1.02 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.619 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 1.44 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.685 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.99 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.795 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 1.05 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 1.0 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.674 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 2.42 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 1.01 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.674 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.63 109.056 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.587 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.67 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.587 ' OE2' ' HG3' ' A' ' 66' ' ' ARG . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.658 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 27.6 t-80 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.19 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 1.09 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.782 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 1.05 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.497 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 1.05 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.722 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.97 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.87 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.65 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 1.03 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.722 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.68 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.704 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 1.01 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.723 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.97 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 1.04 110.544 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.578 ' HA ' ' CG2' ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.636 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 1.02 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 1.59 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 1.0 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.622 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 1.0 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.569 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 1.02 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.694 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 1.04 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.662 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 3.37 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.694 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.17 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.531 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.99 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.622 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 1.03 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 1.04 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.678 ' C ' HG22 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.605 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 1.03 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.583 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 1.02 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.633 ' HA ' HD22 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 1.01 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 1.31 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 1.02 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 2.48 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.49 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 1.03 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 1.06 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.92 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.98 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.52 ' HZ3' ' HB3' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.78 108.094 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.701 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 1.05 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.456 HG22 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 1.03 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 2.41 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.578 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.9 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.579 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.79 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 1.06 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.803 ' O ' HG22 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 1.03 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.79 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.9 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.803 HG22 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 1.03 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 1.02 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.583 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 2.23 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.662 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 1.02 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.701 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.99 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.99 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 1.02 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.49 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.461 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 70.3 t . . . . . 0 N--CA 1.44 -0.959 0 N-CA-C 112.65 0.611 . . . . 1.65 112.65 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.567 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.14 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.66 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 1.05 111.015 -176.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.718 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 1.26 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.87 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.53 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 1.04 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.718 ' HD2' ' O ' ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.614 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.52 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 1.01 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.593 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.95 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.593 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.81 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.448 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 1.28 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.788 HG21 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 1.01 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.714 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 1.04 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.602 HD21 ' CG2' ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 1.02 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 2.38 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.81 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.1 mm100 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.88 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.57 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.17 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.645 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 2.11 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.628 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 1.03 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.76 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.747 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.9 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 1.02 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.649 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 1.44 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.612 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.99 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.8 ' O ' HD21 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 1.05 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.536 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 1.0 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 2.42 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.8 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 1.01 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.63 109.312 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.67 110.784 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.41 ' HG2' ' CG2' ' A' ' 25' ' ' VAL . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.643 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 28.7 t-80 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.19 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 1.09 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.781 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 1.05 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.475 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 1.05 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.658 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.97 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.87 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.65 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 1.03 110.584 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.68 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.692 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 1.01 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.97 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.408 HG21 HG21 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 1.04 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HB3' HD21 ' A' ' 124' ' ' LEU . 44.5 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.628 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 1.02 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 1.59 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 1.0 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.624 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 1.0 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.771 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.8 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 1.02 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.692 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.771 ' HB1' ' O ' ' A' ' 86' ' ' GLN . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 1.04 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.7 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.668 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 3.37 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.692 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.17 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.534 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.99 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.624 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 1.03 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 1.04 109.412 -175.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.714 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 1.03 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.59 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 1.02 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.493 ' HB3' ' HB3' ' A' ' 106' ' ' ALA . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.648 ' HA ' HD22 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 1.01 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 1.31 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 1.02 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.668 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 2.48 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.444 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 1.03 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 1.06 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.92 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.484 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.7 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.98 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.78 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.668 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 1.05 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.477 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 1.03 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 2.41 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.546 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.9 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 1.06 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.788 ' OE2' HG21 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.739 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 1.03 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.501 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.9 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 1.03 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 1.02 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.59 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 2.23 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 1.02 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.668 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.99 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.99 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.648 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 1.02 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.436 HG12 ' ND2' ' A' ' 29' ' ' ASN . 53.8 t . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 113.145 0.795 . . . . 1.65 113.145 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.613 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.14 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.534 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 1.05 110.801 -175.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 1.26 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.696 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.87 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 1.04 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.708 ' CG ' HD13 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.672 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.52 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 1.01 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.604 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.95 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.604 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.81 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 1.28 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.501 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 1.01 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.62 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 1.04 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.578 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 1.02 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 2.38 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.81 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 11.0 mm100 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.88 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.588 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.17 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.545 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 2.11 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.617 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 1.03 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.76 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.632 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.493 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 1.02 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.596 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 1.44 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.679 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.99 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 1.05 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 1.0 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.687 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 2.42 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 1.01 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.687 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.63 110.113 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.67 110.268 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.427 ' OE1' HD11 ' A' ' 70' ' ' LEU . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.0 t-80 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.19 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 1.09 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.772 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 1.05 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.482 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 1.05 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.648 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.97 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.87 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.772 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.65 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 1.03 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.68 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.708 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 1.01 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.97 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 1.04 110.622 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.576 ' HA ' ' CG2' ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.617 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 1.02 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 1.59 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 1.0 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.632 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 1.0 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.808 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.8 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.605 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 1.02 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.808 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 1.04 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.669 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.689 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.67 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 3.37 107.334 173.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.17 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.539 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.99 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.632 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 1.03 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 1.04 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.682 ' C ' HG23 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.62 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 1.03 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.583 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 1.02 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.623 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 1.01 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 1.31 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 1.02 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.67 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 2.48 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 1.03 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.625 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 1.06 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.92 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.98 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.78 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.699 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 1.05 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.444 HG23 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 1.03 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 2.41 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.576 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.9 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.781 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 1.06 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG21 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 1.03 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.506 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.9 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.795 HG21 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 1.03 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 1.02 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.583 ' C ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 2.23 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.689 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 1.02 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.699 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.99 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.99 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 1.02 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.503 HG13 ' HG3' ' A' ' 67' ' ' GLU . 1.7 m . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 113.54 0.941 . . . . 1.65 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.581 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.14 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.577 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 1.05 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.589 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 1.26 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.698 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.87 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 1.04 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.625 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.52 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.676 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 1.01 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.95 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.42 ' O ' HG21 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.81 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.422 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 1.28 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.468 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 1.01 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.61 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 1.04 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.559 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 1.02 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG21 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 2.38 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.893 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.81 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 15.1 mm100 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.88 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.495 ' CE2' HG23 ' A' ' 82' ' ' ILE . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.17 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.539 ' HD2' HD12 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 2.11 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 1.03 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.76 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.653 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 1.02 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.617 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 1.44 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.99 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 1.05 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 1.0 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.665 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 2.42 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.784 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 1.01 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.665 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.63 109.582 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.67 112.348 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.503 ' HG3' HG13 ' A' ' 25' ' ' VAL . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.606 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.8 t-80 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.19 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 1.09 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 1.05 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.482 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 1.05 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.97 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.87 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.65 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 1.03 110.776 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.647 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.583 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.68 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 1.01 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.97 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 1.04 110.6 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD23 ' A' ' 124' ' ' LEU . 40.0 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 1.02 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 1.59 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.617 HG21 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 1.0 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.578 ' HG3' HD13 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.557 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 1.02 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 1.04 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.706 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.689 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.669 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 3.37 109.17 169.643 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.17 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.536 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.99 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.617 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 1.03 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.893 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 1.04 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.676 ' C ' HG22 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.61 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 1.03 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.576 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 1.02 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.476 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.643 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 1.01 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 1.31 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 1.02 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.669 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 2.48 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.518 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 1.03 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 1.06 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.92 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.706 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.98 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.78 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.679 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 1.05 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 1.03 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 2.41 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.579 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.9 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 1.06 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 1.03 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.522 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.9 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 1.03 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 1.02 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 2.23 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.689 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 1.02 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.679 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.99 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.99 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 1.02 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.518 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.472 HG13 ' ND2' ' A' ' 29' ' ' ASN . 42.6 t . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 112.491 0.552 . . . . 1.65 112.491 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 58' ' ' LEU . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.472 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 1.05 111.186 -173.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.568 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 1.26 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.732 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.87 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 1.04 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.729 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.658 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.52 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.661 HG23 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 1.01 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.432 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.95 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.81 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 1.28 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.601 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 1.01 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.561 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 1.04 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.572 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 1.02 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 2.38 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.65 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.81 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 10.2 mm100 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.88 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.522 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.17 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 2.11 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.604 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 1.03 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.76 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.617 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.421 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 1.02 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.606 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.683 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.99 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.787 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 1.05 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.57 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 1.0 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 2.42 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 1.01 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.63 109.905 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.67 110.154 176.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.47 ' OE1' HD13 ' A' ' 70' ' ' LEU . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.64 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.6 t-80 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.19 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 1.09 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.737 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 1.05 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.51 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 1.05 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.97 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.87 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.65 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.59 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 1.03 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.624 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.68 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.729 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 1.01 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.97 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 1.04 110.808 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.572 ' HB3' HD22 ' A' ' 124' ' ' LEU . 37.3 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.604 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 1.02 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 1.59 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 1.0 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.638 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 1.0 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.696 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.8 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.604 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 1.02 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.674 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 1.04 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.683 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.681 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 3.37 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.674 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.17 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.99 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 1.03 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.65 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 1.04 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.661 ' C ' HG23 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.561 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 1.03 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.578 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 1.02 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.474 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.633 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 1.01 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 1.31 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.427 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 1.02 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.667 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 2.48 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.512 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 1.03 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.641 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 1.06 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.92 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 109' ' ' LYS . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.683 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.98 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.78 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.699 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.405 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 1.05 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.492 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 1.03 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 2.41 109.869 169.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.54 ' HB ' ' HG3' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.9 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.601 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.841 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 1.06 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.789 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 1.03 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.631 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.841 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.9 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.789 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 1.03 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 1.02 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.578 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 2.23 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.681 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 1.02 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.699 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.99 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.99 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 1.02 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.512 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.405 HG12 ' ND2' ' A' ' 29' ' ' ASN . 55.8 t . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 112.994 0.739 . . . . 1.65 112.994 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.549 ' HA ' HD13 ' A' ' 58' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.14 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.405 ' ND2' HG12 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 1.05 111.166 -174.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.648 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 1.26 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.87 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.548 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 1.04 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD12 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.607 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.52 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.684 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 1.01 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.95 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.81 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.464 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 1.28 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.758 HG23 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 1.01 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.695 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 1.04 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.565 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 1.02 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 2.38 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.81 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.9 mm100 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.88 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.555 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.17 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.612 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 2.11 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.613 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 1.03 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.76 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.648 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.464 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 1.02 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.646 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 1.44 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.677 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.99 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 1.05 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.542 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.709 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 2.42 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.788 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 1.01 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.709 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.63 109.796 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.67 111.443 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.667 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.8 t-80 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.19 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 1.09 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.709 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 1.05 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.516 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 1.05 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.97 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.87 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.65 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.646 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 1.03 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.68 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 1.01 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.97 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 1.04 110.586 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.59 ' HB3' HD22 ' A' ' 124' ' ' LEU . 42.1 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.613 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 1.02 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.719 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 1.59 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 1.0 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.675 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.607 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 1.02 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.668 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 1.04 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.673 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.655 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 3.37 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.668 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.17 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.522 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.99 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.648 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 1.03 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 1.04 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.684 ' C ' HG23 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.695 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 1.03 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.582 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 1.02 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.51 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.626 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 1.01 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 1.31 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 1.02 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.655 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 2.48 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.5 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 1.03 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.517 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 1.06 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.92 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.452 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.98 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.78 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG21 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 1.05 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.456 HG23 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 1.03 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 2.41 109.609 169.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.546 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.9 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 1.06 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.758 ' OE2' HG23 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 1.03 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.9 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 1.03 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 1.02 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.582 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 2.23 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.673 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 1.02 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.695 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.99 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.99 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.626 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 1.02 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.5 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 67' ' ' GLU . 1.9 m . . . . . 0 N--CA 1.439 -1.009 0 N-CA-C 113.133 0.79 . . . . 1.65 113.133 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.581 ' HA ' HD13 ' A' ' 58' ' ' LEU . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.578 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.4 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 1.05 111.051 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.616 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 1.26 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.582 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.87 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 1.04 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.632 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.52 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.679 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 1.01 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.557 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.95 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.557 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.81 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.458 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 1.28 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.433 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 1.01 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.598 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 1.04 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.57 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 1.02 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.455 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 2.38 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.674 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.81 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.517 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.9 mm100 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.88 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.52 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.17 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.554 ' CD ' HD13 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 2.11 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.612 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 1.03 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.76 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.612 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.473 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 1.02 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.563 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 1.44 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.656 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.99 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 1.05 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.599 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 1.0 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.644 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.656 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 2.42 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.778 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 1.01 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.63 109.192 -177.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.67 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.586 ' OE1' HD11 ' A' ' 70' ' ' LEU . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.599 ' NE2' HD11 ' A' ' 59' ' ' LEU . 26.2 t-80 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.19 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 1.09 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.754 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 1.05 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.501 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 1.05 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.61 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.97 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.87 109.843 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.754 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.65 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 1.03 110.826 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.68 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 1.01 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.704 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.97 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 1.04 110.634 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.587 ' HB3' HD22 ' A' ' 124' ' ' LEU . 40.3 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.612 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 1.02 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.704 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 1.59 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 1.0 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.625 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 1.0 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.663 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.461 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 1.02 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.663 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 1.04 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.715 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.679 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 3.37 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.17 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.515 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.99 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.625 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 1.03 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.674 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 1.04 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.679 ' C ' HG23 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.598 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 1.03 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.572 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 1.02 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.615 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 1.01 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 1.31 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.414 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 1.02 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 2.48 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 1.03 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 1.06 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.92 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.715 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.98 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.78 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG22 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 1.05 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.476 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 1.03 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 2.41 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.554 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.9 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 1.06 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.767 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 1.03 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.502 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.9 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.778 HG21 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 1.03 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 1.02 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.572 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 2.23 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.679 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 1.02 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.99 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.99 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 1.02 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG22 ' HG3' ' A' ' 67' ' ' GLU . 54.1 t . . . . . 0 N--CA 1.427 -1.594 0 CA-C-O 121.507 0.67 . . . . 1.65 111.134 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.579 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.14 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.581 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 1.05 110.953 -175.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.61 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 1.26 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.709 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.87 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 48' ' ' GLN . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 1.04 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD12 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.52 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.671 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 1.01 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.534 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.95 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.534 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.81 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.403 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 1.28 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 1.01 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.626 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 1.04 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.56 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 1.02 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 2.38 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.899 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.81 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 13.7 mm100 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.88 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HG22 ' A' ' 82' ' ' ILE . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.17 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.561 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 2.11 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 1.03 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.76 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.661 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 1.02 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 1.44 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.661 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.99 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.655 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 1.05 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.803 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 57' ' ' THR . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 2.42 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.684 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 1.01 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.803 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.63 109.294 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.67 110.526 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.435 ' HG3' HG22 ' A' ' 25' ' ' VAL . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.684 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.9 t-80 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.19 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 1.09 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 1.05 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.471 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 1.05 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.97 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.87 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.65 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 1.03 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.601 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.68 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.737 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 1.01 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.713 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.97 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 1.04 110.654 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.562 ' HB3' HD23 ' A' ' 124' ' ' LEU . 48.5 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.599 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 1.02 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.713 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 1.59 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 1.0 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.623 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 1.0 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.583 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 1.02 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.678 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 1.04 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.718 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.673 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.665 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.544 ' HZ2' ' HB3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 3.37 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.678 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.17 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.99 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.623 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 1.03 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.899 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 1.04 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.671 ' C ' HG23 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.626 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 1.03 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.6 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 1.02 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.486 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.63 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 1.01 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 1.31 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 1.02 111.477 -175.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.665 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 2.48 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . 0.572 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 1.03 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 1.06 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.92 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.718 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.98 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.78 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.72 ' CG ' HG21 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 1.05 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 1.03 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.463 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 2.41 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.561 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.9 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.773 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 1.06 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.784 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 1.03 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.773 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.9 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 1.03 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 1.02 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.6 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 2.23 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.673 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 1.02 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.72 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.99 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.99 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.63 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 1.02 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . 0.572 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.936 -0.466 . . . . 22.71 111.936 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -100.48 -7.59 24.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.848 0.356 . . . . 23.63 110.687 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 58.8 ttp -76.59 -52.32 9.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 22.32 110.096 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 60.82 81.33 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.843 0.714 . . . . 20.7 111.697 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.9 m -105.15 151.6 7.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.926 -0.579 . . . . 18.63 109.907 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.06 -163.85 1.57 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.508 -0.314 . . . . 16.83 110.617 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -4.29 45.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.73 -0.214 . . . . 17.9 111.195 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -53.97 -55.53 26.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.234 -0.439 . . . . 15.17 111.159 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.4 m -116.51 52.79 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.634 0.731 . . . . 13.97 110.23 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -140.01 50.11 1.74 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.638 -0.875 . . . . 15.02 108.638 176.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 68.79 173.32 0.29 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 114.488 -1.233 . . . . 13.16 110.93 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.8 mt -88.6 83.49 2.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.93 -0.577 . . . . 10.53 109.852 178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.44 -173.61 3.73 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.885 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 m 72.16 163.23 0.27 Allowed 'General case' 0 CA--C 1.536 0.421 0 O-C-N 123.784 0.677 . . . . 7.72 110.475 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m 69.24 16.68 8.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.609 0.719 . . . . 6.27 110.188 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -140.6 54.17 1.6 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.34 -0.985 . . . . 6.79 108.34 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m 64.75 -172.51 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.822 -1.081 . . . . 3.15 110.178 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -71.36 148.37 47.08 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.915 0.388 . . . . 1.91 111.187 178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.469 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 38.3 m -142.87 146.53 34.19 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.294 0.568 . . . . 1.32 110.821 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.523 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -77.52 -174.22 3.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 122.329 1.062 . . . . 1.12 112.104 -175.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.3 m-80 -129.83 158.2 40.11 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.323 -1.762 . . . . 0.43 107.041 -173.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.521 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -78.9 -15.53 58.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.816 0.735 . . . . 1.0 111.2 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 t -80.25 -10.27 59.75 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 107.782 -1.192 . . . . 1.88 107.782 171.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.598 ' HB3' HD11 ' A' ' 62' ' ' LEU . 86.9 m-20 -98.53 -44.43 6.48 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.199 -1.364 . . . . 1.27 109.617 175.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.521 ' HB ' HE21 ' A' ' 22' ' ' GLN . 78.7 t -90.87 -54.47 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 114.031 -1.441 . . . . 1.65 112.908 -167.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.503 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.14 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 1.05 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.564 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 1.26 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.679 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.87 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 1.04 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD12 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.669 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.52 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.586 HG22 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 1.01 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.494 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.95 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.494 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 14.5 m120 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.81 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.405 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 1.28 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 1.01 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.588 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 1.04 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.55 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 1.02 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.521 ' HG2' HG21 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 2.38 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.685 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.81 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.554 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.2 mm100 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.88 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.528 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.17 112.003 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HD2' HD11 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 2.11 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.623 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 1.03 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.76 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.642 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.486 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 1.02 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 1.44 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.643 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.99 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 1.05 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 1.0 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 2.42 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.788 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 1.01 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.485 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.63 109.136 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.67 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.523 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.656 ' NE2' HD11 ' A' ' 59' ' ' LEU . 33.1 t-80 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.19 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 1.09 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.777 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 1.05 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.496 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 1.05 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.712 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.97 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.87 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.65 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 1.03 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.609 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.68 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.732 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 1.01 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.734 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.97 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.415 HG23 HG21 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 1.04 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.587 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.3 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.623 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 1.02 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.734 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 1.59 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.641 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 1.0 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.643 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.421 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 1.02 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.643 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 1.04 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.705 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.672 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.658 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.537 ' HZ2' ' HB2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 3.37 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.662 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.17 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.99 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.641 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 1.03 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.685 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 1.04 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.586 ' C ' HG22 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.588 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 1.03 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.57 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 1.02 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 1.01 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 1.31 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 1.02 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.658 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 2.48 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.401 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 1.03 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.598 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 1.06 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.92 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 109' ' ' LYS . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.705 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.98 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.522 ' HZ1' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.78 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.65 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 1.05 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.419 HG23 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 1.03 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.464 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 2.41 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.587 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.9 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 1.06 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.782 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 1.03 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.9 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 1.03 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 1.02 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.581 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 2.23 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.672 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 1.02 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.65 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.99 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.99 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.631 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 1.02 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.401 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.837 -0.505 . . . . 22.71 111.837 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -133.51 76.59 1.68 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.243 0.544 . . . . 23.63 110.415 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 42.9 ttm -88.59 -48.11 7.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.582 -0.735 . . . . 22.32 110.075 177.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -93.85 64.08 3.38 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.364 -0.835 . . . . 20.7 110.566 -175.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.5 -38.5 46.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.318 0.58 . . . . 18.63 109.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.9 113.55 24.32 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.622 -0.717 . . . . 16.83 110.057 176.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.428 ' HD2' ' N ' ' A' ' 8' ' ' SER . 3.7 ppt_? -68.43 -18.46 64.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 17.9 111.064 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.428 ' N ' ' HD2' ' A' ' 7' ' ' ARG . 52.4 p -165.01 -52.36 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 15.17 110.052 173.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 t -170.74 145.59 2.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.041 -0.527 . . . . 13.97 111.244 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -146.03 10.79 1.18 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.526 0.679 . . . . 15.02 109.324 172.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.577 ' HG2' ' H ' ' A' ' 12' ' ' ILE . 30.8 tt0 -137.12 -173.92 3.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.479 -0.934 . . . . 13.16 108.479 -175.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.577 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 71.3 mt -68.49 86.33 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.311 0.577 . . . . 10.53 109.687 171.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -135.51 -14.2 1.96 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.64 -0.709 . . . . 10.66 110.436 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.4 t -128.22 23.98 5.97 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.542 -0.754 . . . . 7.72 110.166 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.464 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 12.8 p -67.04 123.09 19.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.459 -0.791 . . . . 6.27 109.869 177.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.464 ' HB3' ' O ' ' A' ' 15' ' ' SER . 6.7 tt0 70.68 -67.3 0.25 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.615 0.572 . . . . 6.79 110.442 -175.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.4 m -128.35 168.83 14.99 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 3.15 110.103 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 82.2 p -77.02 -160.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.988 -0.551 . . . . 1.91 110.907 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.533 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 33.1 m -117.15 140.91 48.94 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.358 -0.608 . . . . 1.32 109.358 167.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.539 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -71.41 172.97 8.5 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 122.541 1.162 . . . . 1.12 112.359 -172.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.8 m-80 -115.28 153.23 31.3 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 112.728 -2.033 . . . . 0.43 107.59 -173.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.564 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -77.7 -10.5 59.56 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.076 -0.65 . . . . 1.0 110.914 -177.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 p -83.82 -9.93 58.42 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.515 -0.92 . . . . 1.88 108.515 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.551 ' HB3' HD12 ' A' ' 62' ' ' LEU . 82.5 m-20 -98.12 -46.99 5.66 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.36 -1.291 . . . . 1.27 109.066 174.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.564 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 77.6 t -85.29 -53.93 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 113.667 -1.606 . . . . 1.65 112.871 -165.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.531 ' HA ' HD11 ' A' ' 58' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.14 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.583 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 1.05 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.577 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 1.26 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.58 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.87 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 1.04 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.712 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.651 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.52 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.616 HG23 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 1.01 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.449 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 5.6 p-10 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.95 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.449 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.81 108.822 169.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.427 ' HG2' ' CD2' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 1.28 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.412 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 1.01 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.588 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 1.04 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.556 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 1.02 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 2.38 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.902 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.81 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 12.5 mm100 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.88 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.54 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.17 111.125 -178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.547 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 2.11 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 1.03 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.76 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.62 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.495 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 1.02 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.677 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 1.44 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.645 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.99 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.79 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 1.05 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.63 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 1.0 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.692 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 2.42 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 1.01 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.692 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.515 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.63 109.501 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.67 111.899 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.539 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.65 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 36.1 t-80 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.19 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 1.09 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 1.05 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.485 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 1.05 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.707 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.97 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.87 109.771 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.65 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.677 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 1.03 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.707 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.58 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.68 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.712 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 1.01 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.97 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 1.04 110.645 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.599 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 37.5 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.6 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 1.02 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.729 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 1.59 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 1.0 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.612 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 1.0 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.682 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.44 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.635 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 1.02 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.682 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 1.04 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.667 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.728 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.693 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 3.37 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.17 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.525 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.99 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.612 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 1.03 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.902 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 1.04 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.616 ' C ' HG23 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.588 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 1.03 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.582 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 1.02 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.646 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 1.01 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 1.31 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 1.02 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.693 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 2.48 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 1.03 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.592 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 1.06 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.92 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 109' ' ' LYS . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.667 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.98 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.78 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.726 ' CG ' HG21 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 1.05 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 1.03 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.8 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 2.41 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.599 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.9 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.459 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 1.06 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.78 ' O ' HG22 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.751 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 1.03 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.8 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.9 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.78 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 1.03 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.751 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 1.02 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 2.23 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 1.02 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.726 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.99 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.99 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 1.02 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.072 -0.411 . . . . 22.71 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -132.84 31.4 3.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.79 0.329 . . . . 23.63 110.685 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt 66.37 107.21 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.396 -0.82 . . . . 22.32 111.999 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -98.23 -85.54 0.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.071 -0.513 . . . . 20.7 110.161 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.0 m -137.97 158.39 33.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.976 -0.556 . . . . 18.63 109.657 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.95 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.744 0.652 . . . . 16.83 111.116 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -65.46 -20.01 66.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.156 -0.474 . . . . 17.9 111.447 -176.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m 60.98 -159.51 0.32 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.786 -0.643 . . . . 15.17 111.189 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.7 m -89.51 -60.17 2.02 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.906 -0.405 . . . . 13.97 109.906 175.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -164.68 -59.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.962 -0.755 . . . . 15.02 108.962 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -133.02 153.92 51.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 13.16 109.502 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.12 85.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.291 0.567 . . . . 10.53 110.378 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -131.42 -66.01 0.74 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.674 -0.694 . . . . 10.66 109.785 177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.504 HG23 HG22 ' A' ' 18' ' ' THR . 9.8 m -139.8 57.17 1.63 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.724 -1.126 . . . . 7.72 109.29 -176.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -76.84 -20.3 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.828 -0.624 . . . . 6.27 111.717 -174.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -130.5 39.38 3.63 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.653 0.739 . . . . 6.79 109.866 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m 58.96 -168.61 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.901 -1.045 . . . . 3.15 112.141 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.504 HG22 HG23 ' A' ' 14' ' ' THR . 25.7 p -141.29 159.85 41.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.331 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.437 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 30.1 m -145.98 143.18 29.32 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.452 0.644 . . . . 1.32 110.547 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.547 ' CB ' HD12 ' A' ' 62' ' ' LEU . . . -74.31 174.37 8.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.642 -1.163 . . . . 1.12 112.257 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 9.8 m-80 -112.42 150.72 30.75 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.79 -2.004 . . . . 0.43 107.46 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.613 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -76.34 -9.75 58.88 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.76 -178.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 p -82.29 -14.4 55.45 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.483 -0.932 . . . . 1.88 108.483 170.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.549 ' HB3' HD11 ' A' ' 62' ' ' LEU . 80.1 m-20 -93.02 -47.06 7.18 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.324 -1.307 . . . . 1.27 108.765 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.613 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 55.4 t -82.58 -48.62 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.076 -1.875 . . . . 1.65 112.624 -166.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 58' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.14 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.433 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 1.05 111.178 -175.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.632 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 1.26 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.87 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 1.04 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CG ' HD12 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.667 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.52 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.644 HG23 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 1.01 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.95 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.81 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 1.28 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.403 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 1.01 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.597 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 1.04 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.558 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 1.02 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 2.38 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.88 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.81 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.536 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.6 mm100 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.88 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.535 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.17 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.531 ' CD ' HD12 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 2.11 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.606 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 1.03 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.76 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.622 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 1.02 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 1.44 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.66 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.99 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.792 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 1.05 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 1.0 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.707 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 2.42 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.792 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 1.01 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.707 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.528 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.63 109.587 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.512 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.67 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.621 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.4 t-80 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.19 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 1.09 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.787 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 1.05 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.451 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 1.05 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.719 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.97 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.87 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.787 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.65 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 1.03 110.933 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.719 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.571 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.68 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.72 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 1.01 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.723 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.97 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.404 HG21 HG23 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 1.04 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.592 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.7 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.606 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 1.02 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 1.59 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 1.0 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.636 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 1.0 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.758 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.7 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.618 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 1.02 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.681 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.758 ' HB1' ' O ' ' A' ' 86' ' ' GLN . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 1.04 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.757 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 3.37 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.681 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.17 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.99 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.636 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 1.03 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.88 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 1.04 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.644 ' C ' HG23 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.597 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 1.03 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.589 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 1.02 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.451 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 1.01 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 1.31 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.412 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 1.02 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 2.48 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.496 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 1.03 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.605 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 1.06 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.92 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.757 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.98 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.78 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.697 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 1.05 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.415 HG22 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 1.03 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 2.41 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.592 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.9 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.513 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 1.06 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG21 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 1.03 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.514 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.9 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.809 HG21 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 1.03 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 1.02 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.589 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 2.23 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 1.02 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.697 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.99 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.99 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 1.02 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.496 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 112.019 -0.432 . . . . 22.71 112.019 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -103.85 -60.83 1.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.731 -0.276 . . . . 23.63 111.531 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -91.28 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.942 0.349 . . . . 22.32 111.942 -174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 56.27 88.07 0.05 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 122.911 0.484 . . . . 20.7 111.404 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -69.25 137.63 23.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.01 -0.541 . . . . 18.63 110.777 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.62 137.57 33.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 16.83 110.361 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.76 -32.16 72.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.443 -0.798 . . . . 17.9 110.86 -175.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 t 68.82 -71.37 0.12 Allowed 'General case' 0 CA--C 1.531 0.218 0 O-C-N 124.143 0.902 . . . . 15.17 110.777 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 29.2 m -83.49 103.25 12.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 120.997 0.427 . . . . 13.97 110.358 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.573 ' HZ1' ' HB3' ' A' ' 10' ' ' LYS . 7.7 ttpm? -106.58 -56.97 2.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.177 -0.465 . . . . 15.02 109.754 178.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 65.75 137.35 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 O-C-N 124.074 0.859 . . . . 13.16 111.255 -178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.473 ' N ' HD13 ' A' ' 12' ' ' ILE . 2.6 mp -73.08 86.16 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.403 0.62 . . . . 10.53 109.879 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -127.59 -28.08 2.79 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.256 -0.884 . . . . 10.66 110.386 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.0 t -74.89 139.34 43.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.065 -0.516 . . . . 7.72 110.322 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 t 63.27 36.84 11.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.584 0.707 . . . . 6.27 109.795 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -91.72 -72.94 0.56 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.494 -0.775 . . . . 6.79 111.178 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m 55.77 72.9 0.46 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.705 -0.68 . . . . 3.15 110.354 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 78.7 p 61.13 146.71 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.341 1.057 . . . . 1.91 113.026 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 22.2 m -140.74 148.8 41.27 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.703 -0.68 . . . . 1.32 109.681 173.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.638 ' CB ' HD13 ' A' ' 62' ' ' LEU . . . -84.72 172.46 11.5 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.281 -0.872 . . . . 1.12 111.158 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' HB2' ' CG ' ' A' ' 24' ' ' ASP . 12.4 m-80 -108.04 171.05 7.62 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.971 -1.468 . . . . 0.43 108.08 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.676 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 13.0 mm-40 -84.25 -18.38 36.66 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 119.863 1.211 . . . . 1.0 111.478 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m -78.01 -10.3 59.53 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.493 -1.299 . . . . 1.88 107.493 171.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.626 ' HB3' HD12 ' A' ' 62' ' ' LEU . 40.5 m-20 -97.97 -46.82 5.77 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 113.782 -1.554 . . . . 1.27 108.877 175.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.676 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 92.9 t -96.31 -61.64 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 CA-C-N 113.693 -1.594 . . . . 1.65 112.407 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.576 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.14 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.571 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 1.05 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.577 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 1.26 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.576 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.87 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 1.04 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.719 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.633 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.52 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.629 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 1.01 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.95 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.425 ' O ' HG22 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.81 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.428 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 1.28 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 1.01 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.576 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 1.04 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.565 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 1.02 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 2.38 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.81 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.52 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.3 mm100 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.88 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.532 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.17 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.551 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 2.11 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.621 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 1.03 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.76 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.517 ' HA ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 1.02 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.616 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 1.44 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.684 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.99 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 1.05 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 1.0 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.662 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 2.42 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 1.01 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.662 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.459 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.63 109.061 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 18' ' ' THR . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.67 111.438 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.562 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.629 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 27.7 t-80 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.19 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 1.09 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.754 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 1.05 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.486 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 1.05 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.97 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.87 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.754 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.65 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 1.03 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.68 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.719 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 1.01 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.725 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.97 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 1.04 110.504 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.581 ' HB3' HD21 ' A' ' 124' ' ' LEU . 40.5 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.621 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 1.02 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.725 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 1.59 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 1.0 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.641 HG22 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 1.0 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.708 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.406 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 1.02 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.687 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.708 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 1.04 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.67 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.689 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 3.37 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.17 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.525 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.99 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.641 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 1.03 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.707 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 1.04 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.629 ' C ' HG22 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.576 ' HA3' ' HB3' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 1.03 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.578 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 1.02 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.506 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.641 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 1.01 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.424 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 1.31 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.506 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 1.02 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.689 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 2.48 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.488 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 1.03 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.621 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 1.06 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.92 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.98 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.78 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.687 ' CG ' HG22 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 1.05 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.43 HG21 ' HB1' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 1.03 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 2.41 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.57 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.9 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 1.06 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.798 ' O ' HG21 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 1.03 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.496 ' HA ' HD11 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.9 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.798 HG21 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 1.03 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 1.02 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 2.23 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.67 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 1.02 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.687 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.99 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.99 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.641 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 1.02 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.488 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.969 -0.452 . . . . 22.71 111.969 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 m80 58.65 34.69 24.0 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.065 0.546 . . . . 23.63 111.36 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.3 mtp -107.49 15.61 24.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 22.32 110.036 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 60.1 87.06 0.09 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 114.841 -1.072 . . . . 20.7 111.086 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -71.35 98.47 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.759 -0.655 . . . . 18.63 110.345 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -129.76 -156.66 0.77 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 16.83 109.956 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -83.19 -33.67 26.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.085 0.469 . . . . 17.9 110.177 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.2 m -82.54 106.77 14.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.946 -0.57 . . . . 15.17 110.418 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.2 m -77.55 128.36 34.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.788 0.327 . . . . 13.97 110.921 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -84.59 104.37 14.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.137 0.494 . . . . 15.02 110.183 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.423 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 3.0 pt-20 -86.77 110.32 19.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.604 -0.726 . . . . 13.16 111.286 -176.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 64.0 mt -78.1 116.7 22.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.819 -0.628 . . . . 10.53 109.941 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.69 -168.37 1.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.848 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 83.3 m 70.76 -79.03 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.47 0.481 . . . . 7.72 111.167 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.8 t 54.03 -149.37 0.43 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.172 0.189 . . . . 6.27 110.927 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 63.57 78.74 0.28 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.224 0.61 . . . . 6.79 111.101 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m 62.03 -169.35 0.18 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.907 -1.042 . . . . 3.15 110.986 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.551 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 74.4 p -85.28 -176.16 6.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.946 0.403 . . . . 1.91 110.091 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.413 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 8.0 m -109.55 149.55 29.48 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.062 -1.088 . . . . 1.32 108.062 168.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -75.12 -175.83 2.79 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 122.288 1.042 . . . . 1.12 111.622 -174.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -129.66 154.59 46.98 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 113.546 -1.661 . . . . 0.43 107.109 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.539 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -78.83 -10.66 59.86 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.01 -0.676 . . . . 1.0 111.296 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -83.26 -10.89 58.29 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.306 -0.998 . . . . 1.88 108.306 169.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.557 ' HB3' HD11 ' A' ' 62' ' ' LEU . 85.2 m-20 -98.24 -45.63 6.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.377 -1.283 . . . . 1.27 109.431 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.539 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 55.3 t -87.67 -52.83 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 113.741 -1.572 . . . . 1.65 112.977 -167.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.607 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.14 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.575 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 1.05 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.723 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 1.26 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.575 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.87 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 1.04 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.719 ' CG ' HD12 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.637 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.52 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.656 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 1.01 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.95 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.459 ' O ' HG22 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.81 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 1.28 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.524 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 1.01 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.576 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 1.04 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.547 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 1.02 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.403 ' O ' ' CE2' ' A' ' 49' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 2.38 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.81 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.649 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.88 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.487 ' CE2' HG21 ' A' ' 82' ' ' ILE . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.17 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.57 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 2.11 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.612 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 1.03 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.76 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.656 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.482 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 1.02 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.594 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 1.44 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.99 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.808 ' O ' HD21 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 1.05 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.588 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 1.0 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.814 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 2.42 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.808 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 1.01 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.814 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.424 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.63 109.037 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.67 112.095 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.9 t-80 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.19 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 1.09 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.762 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 1.05 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.508 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 1.05 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.66 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.97 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.87 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.762 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.65 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.594 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 1.03 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.66 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.68 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.719 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 1.01 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.733 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.97 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 1.04 110.586 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD21 ' A' ' 124' ' ' LEU . 38.7 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.612 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 1.02 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.733 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 1.59 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.662 HG22 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 1.0 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.725 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.607 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 1.02 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.679 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.725 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 1.04 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.705 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 3.37 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.679 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.17 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.99 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.662 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 1.03 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 1.04 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.656 ' C ' HG22 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.576 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 1.03 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 1.02 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.5 ' H ' HD11 ' A' ' 102' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.639 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 1.01 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 1.31 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 1.02 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.667 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 2.48 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.51 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 1.03 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.622 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 1.06 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.92 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.705 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.98 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.78 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 1.05 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.49 HG22 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 1.03 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 2.41 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.535 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.9 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.524 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.812 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 1.06 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.76 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.722 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 1.03 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.624 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.9 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.76 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 1.03 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 1.02 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 2.23 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 1.02 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.674 HG21 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.99 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.99 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.639 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 1.02 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.51 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.961 -0.456 . . . . 22.71 111.961 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -114.56 21.98 14.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 23.63 110.978 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.49 -23.77 25.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.516 -0.311 . . . . 22.32 110.694 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 67.54 -76.1 0.06 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.922 0.764 . . . . 20.7 111.568 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.3 t -90.03 59.89 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.501 0.667 . . . . 18.63 109.95 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.42 18.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 16.83 110.837 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -100.51 -31.83 11.08 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.136 -0.484 . . . . 17.9 110.953 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 32.2 m 67.15 -70.45 0.11 Allowed 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.96 0.788 . . . . 15.17 111.085 -178.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 27.1 m -153.19 132.74 12.97 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.991 -0.744 . . . . 13.97 108.991 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 1.08 5.87 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.694 -0.402 . . . . 15.02 111.224 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.92 149.4 51.66 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.935 -0.394 . . . . 13.16 109.935 177.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 65.5 mt -80.04 80.95 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.396 0.617 . . . . 10.53 110.091 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -129.72 -179.16 5.03 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.725 -0.67 . . . . 10.66 109.866 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.5 m 54.6 33.27 18.78 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.836 0.827 . . . . 7.72 111.042 172.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m -88.08 71.91 9.24 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.773 -0.649 . . . . 6.27 110.447 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -122.44 -64.09 1.22 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.368 -0.833 . . . . 6.79 110.216 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 53.6 m -91.04 -165.91 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.967 -0.56 . . . . 3.15 110.479 178.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.556 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 81.5 p -72.77 -159.64 0.06 Allowed 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.611 0.243 . . . . 1.91 110.674 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.492 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 40.6 m -118.15 147.41 43.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.293 -0.632 . . . . 1.32 109.293 167.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.552 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -76.27 -170.32 1.42 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 122.071 0.939 . . . . 1.12 111.578 -175.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.485 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 m-80 -131.43 155.64 46.98 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 113.807 -1.542 . . . . 0.43 106.982 -173.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.586 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -77.47 -13.07 60.0 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 118.975 0.807 . . . . 1.0 110.959 -178.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.7 t -81.03 -11.9 59.45 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.986 -1.116 . . . . 1.88 107.986 171.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.56 ' HB3' HD11 ' A' ' 62' ' ' LEU . 67.7 m-20 -98.21 -45.21 6.28 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 114.206 -1.361 . . . . 1.27 109.155 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.586 ' HB ' HE21 ' A' ' 22' ' ' GLN . 50.7 t -88.55 -51.46 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 113.591 -1.641 . . . . 1.65 113.041 -166.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.579 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.14 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.627 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 1.05 110.91 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.606 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 1.26 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.594 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.87 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 1.04 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.652 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.52 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 1.01 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.552 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.95 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.552 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.81 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 36' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 1.28 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.484 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 1.01 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.568 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 1.04 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.561 HD22 ' CG2' ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 1.02 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 2.38 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.845 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.81 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.524 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.4 mm100 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.88 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.61 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.17 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.574 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 2.11 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 1.03 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.76 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.628 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 1.02 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.604 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 1.44 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.66 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.99 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.789 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 1.05 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.596 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 1.0 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.66 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 2.42 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 1.01 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.506 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.63 109.288 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.556 ' HG2' ' O ' ' A' ' 18' ' ' THR . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.67 111.806 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.552 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.617 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.19 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 1.09 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 1.05 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.501 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 1.05 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.97 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.87 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.65 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 1.03 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.604 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.68 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 1.01 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.713 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.97 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 1.04 110.619 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.585 ' HB3' HD22 ' A' ' 124' ' ' LEU . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.619 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 1.02 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.713 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 1.59 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 1.0 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.622 HG21 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 1.0 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.61 ' NE2' ' HD1' ' A' ' 49' ' ' PHE . 1.7 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 1.02 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 1.04 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.692 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.663 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.665 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 3.37 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.17 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.536 ' HB1' HD11 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.99 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.622 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 1.03 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.845 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 1.04 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.695 ' C ' HG23 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.568 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 1.03 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 1.02 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.453 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.646 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 1.01 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 1.31 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.452 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 1.02 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.665 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 2.48 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 1.03 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.595 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 1.06 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.92 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.692 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.98 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.78 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 1.05 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.437 HG23 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 1.03 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 2.41 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.552 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.9 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.781 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 1.06 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.734 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 1.03 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD11 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.9 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.787 HG22 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 1.03 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 1.02 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.59 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 2.23 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.663 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 1.02 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.705 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.99 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.99 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.646 HD23 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 1.02 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 111.684 -0.566 . . . . 22.71 111.684 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -78.03 -25.37 47.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.085 0.469 . . . . 23.63 110.064 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.2 mtp -148.81 127.02 12.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.527 -0.761 . . . . 22.32 109.98 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -83.51 67.33 9.33 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.128 0.49 . . . . 20.7 109.861 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.0 t 69.42 -73.86 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 114.949 -1.023 . . . . 18.63 110.797 -175.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 54.19 77.55 0.19 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.0 -0.545 . . . . 16.83 111.196 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -65.21 -10.48 32.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.013 -0.539 . . . . 17.9 111.812 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -80.51 7.86 9.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.987 0.422 . . . . 15.17 110.76 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.2 m -95.91 112.22 24.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.21 -0.45 . . . . 13.97 110.86 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.509 ' HZ2' ' HB2' ' A' ' 10' ' ' LYS . 0.1 OUTLIER -103.53 63.68 0.8 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.433 0.635 . . . . 15.02 109.426 177.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -164.88 160.66 19.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.229 -0.896 . . . . 13.16 108.606 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -74.02 82.32 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.532 0.682 . . . . 10.53 111.096 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -136.85 -46.91 0.59 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.224 -0.898 . . . . 10.66 110.132 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.9 m -66.24 162.72 19.38 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 7.72 110.41 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.418 ' HB2' ' OG1' ' A' ' 19' ' ' THR . 46.6 m -54.6 159.55 2.11 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.222 0.534 . . . . 6.27 111.725 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.95 126.56 28.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.508 -0.769 . . . . 6.79 111.528 -175.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.5 m 66.73 -168.37 0.2 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 124.005 0.816 . . . . 3.15 111.044 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 3.7 p -61.22 129.17 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.104 0.478 . . . . 1.91 111.077 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.555 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 25.7 m -128.86 147.86 50.85 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.314 0.578 . . . . 1.32 110.478 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.593 ' CB ' HD12 ' A' ' 62' ' ' LEU . . . -81.48 164.4 22.04 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 122.083 0.944 . . . . 1.12 111.788 -175.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.484 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.5 m-80 -104.55 159.72 15.52 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 113.075 -1.875 . . . . 0.43 107.941 -174.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.565 HE21 ' HB ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -78.64 -14.09 59.49 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 119.778 -0.769 . . . . 1.0 110.909 -178.258 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -80.69 -11.33 59.64 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.26 -1.015 . . . . 1.88 108.26 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.562 ' HB3' HD11 ' A' ' 62' ' ' LEU . 75.6 m-20 -97.12 -44.66 6.86 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.201 -1.363 . . . . 1.27 108.907 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.565 ' HB ' HE21 ' A' ' 22' ' ' GLN . 66.9 t -89.91 -54.75 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 113.604 -1.635 . . . . 1.65 113.154 -167.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HA ' HD11 ' A' ' 58' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.14 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.561 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.414 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 1.05 111.015 -175.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.588 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 1.26 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.87 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 1.04 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.712 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.633 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.52 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.629 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 1.01 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.571 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.95 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.571 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.81 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 1.28 110.532 174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.435 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 1.01 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.602 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 1.04 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.566 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 1.02 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 2.38 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.892 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.81 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.54 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.3 mm100 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.88 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.504 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.17 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.496 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 2.11 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 1.03 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.76 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.621 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.495 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 1.02 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.64 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 1.44 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.678 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.99 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.795 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 1.05 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.543 HD23 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 1.0 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.7 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 2.42 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.795 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 1.01 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.7 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.429 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.63 109.125 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.555 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.67 112.191 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.585 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.652 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.2 t-80 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.19 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 1.09 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 1.05 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.499 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 1.05 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.97 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.87 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.65 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.64 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 1.03 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.715 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.585 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.68 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.712 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 1.01 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.716 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.97 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.402 HG23 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 1.04 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.578 ' HB3' HD22 ' A' ' 124' ' ' LEU . 40.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.624 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 1.02 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.716 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 1.59 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 1.0 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.632 HG22 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 1.0 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.781 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 1.02 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.705 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 1.04 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.682 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.541 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 3.37 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.705 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.17 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.55 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.99 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.632 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 1.03 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.892 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 1.04 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.629 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.602 ' HA3' ' HB3' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 1.03 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.574 HD23 HD12 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 1.02 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.635 ' HA ' HD23 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 1.01 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 1.31 109.272 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.545 ' HA ' ' HD3' ' A' ' 107' ' ' LYS . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 1.02 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.545 ' HD3' ' HA ' ' A' ' 106' ' ' ALA . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 2.48 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 1.03 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.627 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 1.06 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.92 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.682 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.98 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.78 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 1.05 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.427 HG23 ' HB2' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 1.03 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 2.41 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.57 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.9 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.807 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 1.06 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.81 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.754 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 1.03 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.513 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.807 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.9 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 1.03 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.754 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 1.02 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.58 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 2.23 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.677 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 1.02 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.695 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.99 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.99 110.264 -177.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.635 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 1.02 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.634 -0.586 . . . . 22.71 111.634 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -80.46 94.93 6.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.828 0.347 . . . . 23.63 110.151 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.7 ptp -115.02 -13.19 11.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 22.32 111.307 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.448 ' HA ' HE21 ' A' ' 4' ' ' GLN . 0.0 OUTLIER -155.56 132.44 10.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.585 0.231 . . . . 20.7 110.745 -174.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.3 m -123.34 -4.28 7.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.541 -0.3 . . . . 18.63 111.427 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.96 177.99 7.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.521 -0.309 . . . . 16.83 110.444 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.76 -50.12 63.75 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.197 -0.668 . . . . 17.9 109.197 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.477 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 25.0 m 61.08 90.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.447 -0.797 . . . . 15.17 112.363 171.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.9 t -70.54 -24.01 62.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.463 -0.789 . . . . 13.97 110.648 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -153.27 25.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.723 -0.473 . . . . 15.02 109.723 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.477 ' HA ' ' HB3' ' A' ' 8' ' ' SER . 2.8 mp0 66.09 158.55 0.12 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.725 -0.671 . . . . 13.16 111.594 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -103.22 76.01 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.933 -0.576 . . . . 10.53 110.109 174.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -131.66 -60.23 0.94 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.778 -0.646 . . . . 10.66 110.16 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.0 t -100.3 -21.22 15.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.717 -0.674 . . . . 7.72 110.339 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m -68.41 123.91 22.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 6.27 110.843 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -118.85 59.39 0.83 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.697 -0.482 . . . . 6.79 109.697 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.1 m 67.56 -79.8 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.565 -0.743 . . . . 3.15 111.118 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.404 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 2.6 p -151.97 138.61 18.75 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.892 -0.781 . . . . 1.91 108.892 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.502 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 27.6 m -126.74 146.92 50.04 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.588 0.709 . . . . 1.32 111.531 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.522 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -76.35 -177.35 4.04 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.421 -1.263 . . . . 1.12 111.59 -177.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.1 m-80 -124.52 156.76 36.76 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.529 -1.669 . . . . 0.43 107.175 -174.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.545 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -77.31 -14.44 59.74 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.829 -0.748 . . . . 1.0 110.963 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 t -82.19 -9.17 59.6 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.866 -1.161 . . . . 1.88 107.866 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.587 ' HB3' HD12 ' A' ' 62' ' ' LEU . 67.6 m-20 -96.92 -46.98 6.01 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.456 -1.247 . . . . 1.27 108.657 174.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.545 ' HB ' HE21 ' A' ' 22' ' ' GLN . 54.8 t -86.41 -52.74 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 113.224 -1.807 . . . . 1.65 113.003 -165.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 58' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.14 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.528 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 1.05 111.019 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.604 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 1.26 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.559 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.87 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.501 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 1.04 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.71 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.664 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.52 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.702 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 1.01 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.95 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.81 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.418 ' HA ' ' CG ' ' A' ' 36' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 1.28 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.536 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 1.01 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.564 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 1.04 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 1.02 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.525 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 2.38 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.908 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.81 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 8.7 mm100 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.88 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.548 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.17 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.56 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 2.11 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.603 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 1.03 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.76 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.648 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.504 HD11 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 1.02 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.532 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 1.44 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.661 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.99 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 1.05 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.657 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.733 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 2.42 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.781 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 1.01 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.733 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.499 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.63 109.447 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.502 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.67 112.017 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.522 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.669 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 31.4 t-80 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.19 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 1.09 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 1.05 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.498 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 1.05 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.638 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.97 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.87 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.65 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.532 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 1.03 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.638 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.68 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.71 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 1.01 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.694 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.97 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 1.04 110.458 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD23 ' A' ' 124' ' ' LEU . 40.2 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.603 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 1.02 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.694 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 1.59 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 1.0 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.624 HG21 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 1.0 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.573 ' HG3' HD11 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.494 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 1.02 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 1.04 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.674 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 3.37 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.17 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.541 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.99 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.624 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 1.03 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.908 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 1.04 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.702 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.564 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 1.03 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.577 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 1.02 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.475 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.636 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 1.01 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 1.31 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 1.02 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.674 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 2.48 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.557 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 1.03 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.658 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 1.06 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.92 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.418 ' H ' ' C ' ' A' ' 109' ' ' LYS . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.98 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.78 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 1.05 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.432 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 1.03 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 2.41 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.558 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.9 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.8 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 1.06 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.775 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.771 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 1.03 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.509 ' HA ' HD13 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.8 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.9 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 1.03 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 1.02 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.596 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 2.23 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.686 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 1.02 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.99 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.99 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 1.02 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.557 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 112.308 -0.317 . . . . 22.71 112.308 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -83.75 138.01 33.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.844 0.355 . . . . 23.63 111.065 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.4 ttp -151.95 -61.14 0.16 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.959 -0.564 . . . . 22.32 109.784 178.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -164.72 127.75 2.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.368 -0.833 . . . . 20.7 108.768 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.0 t 67.38 90.46 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 O-C-N 123.788 0.68 . . . . 18.63 110.137 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.69 90.12 0.76 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.037 -0.529 . . . . 16.83 110.668 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -60.77 -40.78 93.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.626 -0.715 . . . . 17.9 110.585 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.1 p -86.08 61.85 7.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.063 -0.517 . . . . 15.17 109.712 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.6 m -58.53 97.14 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.631 -0.713 . . . . 13.97 112.022 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -95.26 -14.93 23.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.923 -0.58 . . . . 15.02 109.948 177.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -64.64 142.33 58.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.341 -0.845 . . . . 13.16 109.929 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -76.98 81.23 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.135 0.493 . . . . 10.53 110.25 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.15 156.7 48.02 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.684 -0.689 . . . . 10.66 109.384 177.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 p -116.98 134.4 54.79 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.696 0.284 . . . . 7.72 110.756 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.5 m -81.83 52.57 1.96 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.51 0.672 . . . . 6.27 110.391 178.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.54 135.99 38.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.279 -0.873 . . . . 6.79 109.542 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.9 m -73.55 166.39 23.34 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.368 . . . . 3.15 111.261 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 p -53.52 147.62 10.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.391 -0.822 . . . . 1.91 112.431 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.527 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 9.9 m -135.49 145.77 47.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.061 -0.518 . . . . 1.32 110.516 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.567 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -80.92 169.57 17.37 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 122.062 0.934 . . . . 1.12 111.351 -178.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.5 m-80 -108.64 142.52 39.0 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 113.506 -1.679 . . . . 0.43 106.88 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.47 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 1.1 mp0 -68.29 -13.0 61.94 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 119.21 0.914 . . . . 1.0 111.159 -178.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 p -79.52 -8.32 59.07 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.535 -0.913 . . . . 1.88 108.535 170.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.551 ' HB2' ' O ' ' A' ' 21' ' ' ASN . 79.0 m-20 -99.21 -47.42 5.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 114.421 -1.263 . . . . 1.27 108.421 176.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.476 HG11 ' HG3' ' A' ' 67' ' ' GLU . 1.6 m -92.86 -40.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-N 114.892 -1.049 . . . . 1.65 113.476 -166.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.463 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HA ' HD13 ' A' ' 58' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.14 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.63 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 1.05 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.606 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 1.26 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.582 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.87 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 1.04 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.596 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.52 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.614 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 1.01 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.569 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.95 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.569 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.81 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 1.28 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 1.01 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.589 ' HB2' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 1.04 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.561 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 1.02 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HG2' HG23 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 2.38 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.896 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.81 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.88 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' A' ' 82' ' ' ILE . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.17 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 2.11 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.614 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 1.03 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.76 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.606 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.516 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 1.02 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.605 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 1.44 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.673 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.99 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.79 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 1.05 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.552 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 1.0 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.688 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 2.42 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 1.01 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.688 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.474 ' HB3' ' C ' ' A' ' 19' ' ' THR . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.63 109.55 -179.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.67 111.864 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.567 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.19 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 1.09 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.826 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 1.05 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.488 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 1.05 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.97 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.87 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.65 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.405 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 1.03 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.611 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.68 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.723 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 1.01 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.707 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.97 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 1.04 110.743 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.58 ' HB3' HD21 ' A' ' 124' ' ' LEU . 38.5 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.614 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 1.02 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.707 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 1.59 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 1.0 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.625 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 1.0 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.583 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 1.02 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 1.04 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.706 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.675 ' CE2' ' HB3' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.687 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 3.37 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.17 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.99 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.625 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 1.03 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.896 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 1.04 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.614 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.589 ' HA3' ' HB2' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 1.03 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.572 HD22 HD13 ' A' ' 134' ' ' LEU . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 1.02 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.472 ' H ' HD11 ' A' ' 102' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.631 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 1.01 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 1.31 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 1.02 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.687 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 2.48 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 1.03 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 1.06 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.92 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.706 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.98 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.78 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG21 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 1.05 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.44 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 1.03 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 2.41 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.564 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.9 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.85 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 1.06 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG21 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.747 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 1.03 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.509 ' HA ' HD13 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.85 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.9 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.792 HG21 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 1.03 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.747 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 1.02 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.568 ' C ' HD21 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 2.23 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.675 ' HB3' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 1.02 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.688 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.99 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.99 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 1.02 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.946 -0.461 . . . . 22.71 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 58.29 48.79 12.02 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.51 0.671 . . . . 23.63 110.356 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.459 ' CE ' ' HA ' ' A' ' 3' ' ' MET . 0.9 OUTLIER -116.77 68.7 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.741 -0.663 . . . . 22.32 109.953 176.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.22 110.67 6.83 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.164 -0.925 . . . . 20.7 109.229 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.433 ' HB ' ' O ' ' A' ' 8' ' ' SER . 9.3 m -82.95 96.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.631 0.729 . . . . 18.63 111.068 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.88 -22.84 15.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.749 . . . . 16.83 110.749 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 2.7 tmt_? -83.89 -39.84 19.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.323 -0.621 . . . . 17.9 109.323 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.433 ' O ' ' HB ' ' A' ' 5' ' ' VAL . 7.0 p -119.2 141.47 48.86 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.491 -0.777 . . . . 15.17 110.796 -178.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.5 m 72.43 -77.77 0.05 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.188 -0.46 . . . . 13.97 111.895 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? 53.84 52.09 13.66 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.054 0.542 . . . . 15.02 111.204 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -99.75 145.85 27.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.961 0.41 . . . . 13.16 111.266 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.5 mt -95.31 89.7 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.061 -0.518 . . . . 10.53 110.333 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -125.43 173.28 8.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.248 0.547 . . . . 10.66 111.379 -176.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 p -112.11 83.83 1.86 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.258 -0.883 . . . . 7.72 110.876 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.4 m -71.39 94.54 1.25 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.807 -0.633 . . . . 6.27 111.012 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -163.18 -72.33 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.777 -0.647 . . . . 6.79 110.19 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m -156.78 -168.61 2.72 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.933 -0.576 . . . . 3.15 109.562 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.409 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 24.5 p -62.01 -73.58 0.1 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.469 0.652 . . . . 1.91 109.725 171.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.622 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.1 m 63.39 146.66 0.02 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.927 -1.488 . . . . 1.32 113.309 173.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.538 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -91.96 -172.93 3.32 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.352 -1.294 . . . . 1.12 112.175 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 14.7 m-80 -128.86 158.35 38.99 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.328 -1.76 . . . . 0.43 107.097 -174.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.555 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -79.8 -14.62 58.57 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 118.849 0.75 . . . . 1.0 111.592 -176.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.8 m -81.34 -9.54 59.73 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.036 -1.098 . . . . 1.88 108.036 170.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 21' ' ' ASN . 80.2 m-20 -98.47 -43.66 6.8 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.058 -1.428 . . . . 1.27 109.305 176.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.555 ' HB ' HE21 ' A' ' 22' ' ' GLN . 78.7 t -91.06 -54.21 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 113.986 -1.461 . . . . 1.65 112.928 -168.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.551 ' CE1' HD12 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.14 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.615 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.415 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 1.05 111.156 -176.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.615 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 1.26 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.87 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 1.04 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.637 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.52 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.671 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 1.01 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.95 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.81 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.415 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 1.28 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.47 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 1.01 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.629 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 1.04 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.561 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 1.02 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HG2' HG21 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 2.38 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.4 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.81 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.542 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.88 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.512 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.17 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.56 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 2.11 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 1.03 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.76 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.642 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.551 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 1.02 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 1.44 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.688 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.99 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.803 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 1.05 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 1.0 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.766 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 2.42 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.803 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 1.01 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.766 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.622 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.63 109.704 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.489 ' CG ' ' HA ' ' A' ' 19' ' ' THR . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.67 110.246 177.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.689 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 26.8 t-80 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.19 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 1.09 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 1.05 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.499 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 1.05 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.97 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.87 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.65 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 1.03 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.68 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 1.01 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.97 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 1.04 110.555 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.583 ' CG ' ' HB ' ' A' ' 119' ' ' THR . 41.7 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 1.02 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.72 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 1.59 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 1.0 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.567 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 1.02 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 1.04 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.682 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.69 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 3.37 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.17 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.541 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.99 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.615 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 1.03 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 1.04 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.671 ' C ' HG22 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.629 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 1.03 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.574 HD21 HD12 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 1.02 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.567 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.654 ' HA ' HD23 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 1.01 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.446 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 1.31 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.567 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 1.02 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.69 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 2.48 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.524 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 1.03 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.579 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 1.06 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.92 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.98 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.78 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.687 ' CG ' HG21 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 1.05 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.465 HG22 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 1.03 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 2.41 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.583 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.9 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.558 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 1.06 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.807 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.768 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 1.03 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.9 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.807 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 1.03 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.768 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 1.02 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.576 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 2.23 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.682 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 1.02 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.687 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.99 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.99 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 1.02 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.524 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.145 -0.382 . . . . 22.71 112.145 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -63.19 123.73 19.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.665 0.269 . . . . 23.63 110.633 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.9 ptp -104.46 153.75 20.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.304 0.574 . . . . 22.32 111.104 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -90.22 132.69 35.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.182 -0.917 . . . . 20.7 108.803 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.55 -37.48 58.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 120.932 0.396 . . . . 18.63 110.705 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.74 80.29 7.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.247 -0.649 . . . . 16.83 109.247 171.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.5 mtm180 -55.42 -49.93 71.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.501 -0.772 . . . . 17.9 110.991 -176.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.415 ' O ' ' HB ' ' A' ' 9' ' ' THR . 4.4 p -92.66 9.99 32.5 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.636 -0.711 . . . . 15.17 110.928 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.415 ' HB ' ' O ' ' A' ' 8' ' ' SER . 74.6 m 69.37 -70.87 0.13 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 115.812 -0.631 . . . . 13.97 110.886 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.48 -78.4 0.3 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.161 -0.681 . . . . 15.02 109.161 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 57.16 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.708 0.766 . . . . 13.16 112.402 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.25 98.18 6.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.505 -0.77 . . . . 10.53 110.068 176.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.28 1.66 6.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.922 0.391 . . . . 10.66 111.206 -177.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.487 HG22 ' H ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -97.39 -178.05 4.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.684 -0.487 . . . . 7.72 109.684 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.487 ' H ' HG22 ' A' ' 14' ' ' THR . 38.3 t -56.74 -36.4 69.7 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.614 -0.513 . . . . 6.27 109.614 172.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB3' ' O ' ' A' ' 15' ' ' SER . 47.8 tt0 74.56 -52.81 0.68 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.165 -0.925 . . . . 6.79 111.254 176.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 m -107.48 178.27 4.59 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.024 0.44 . . . . 3.15 110.222 175.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.8 p -88.11 136.92 32.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.497 -0.774 . . . . 1.91 111.527 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.433 ' C ' ' HB3' ' A' ' 65' ' ' SER . 4.0 m -127.85 144.68 51.09 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.899 -0.591 . . . . 1.32 110.658 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.526 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -73.36 -176.96 2.4 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.219 1.009 . . . . 1.12 111.497 -177.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.535 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.9 m-80 -128.3 149.52 50.46 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.589 -1.641 . . . . 0.43 106.86 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.562 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -74.18 -12.84 60.69 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.824 -0.75 . . . . 1.0 111.532 -177.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.1 m -82.12 -10.8 59.06 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 108.352 -0.981 . . . . 1.88 108.352 171.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.552 ' HB3' HD11 ' A' ' 62' ' ' LEU . 76.8 m-20 -97.04 -46.09 6.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.268 -1.333 . . . . 1.27 108.821 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.562 ' HB ' HE21 ' A' ' 22' ' ' GLN . 59.1 t -84.47 -52.57 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 CA-C-N 113.281 -1.781 . . . . 1.65 112.776 -167.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.606 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.14 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.527 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 1.05 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 1.26 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.703 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.87 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.488 ' CG ' ' HZ1' ' A' ' 41' ' ' LYS . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.577 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 1.04 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.666 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.52 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.68 HG23 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 1.01 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.554 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.95 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.81 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.579 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 1.28 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 1.01 109.466 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.694 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 1.04 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.566 HD22 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 1.02 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 2.38 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.886 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.81 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.3 mm100 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.88 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.17 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.576 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 2.11 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.616 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 1.03 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.76 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.627 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 1.02 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.667 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.629 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.99 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.777 ' O ' HD21 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 1.05 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.658 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 1.0 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.695 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 2.42 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 1.01 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.695 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.433 ' HB3' ' C ' ' A' ' 19' ' ' THR . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.63 109.863 -177.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.67 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.668 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 35.7 t-80 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.19 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 1.09 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.789 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 1.05 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.507 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 1.05 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.97 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.87 109.61 178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.789 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.65 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.667 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 1.03 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.622 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.68 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 1.01 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.702 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.97 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 1.04 110.523 178.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.579 ' HB3' HD22 ' A' ' 124' ' ' LEU . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.616 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 1.02 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.702 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 1.59 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.612 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 1.0 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.62 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 1.0 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.599 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 1.02 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 87' ' ' ASP . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 1.04 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.668 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 3.37 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.17 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.54 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.99 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 1.03 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.886 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 1.04 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.68 ' C ' HG23 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.694 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 1.03 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.579 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 1.02 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.527 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.632 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 1.01 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 1.31 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.527 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 1.02 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 2.48 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.437 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 1.03 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 1.06 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.92 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.98 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.78 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.692 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 1.05 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.492 HG22 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 1.03 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 2.41 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.547 ' HB ' ' HG3' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.9 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.534 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 1.06 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.793 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 1.03 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.9 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.8 HG22 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 1.03 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 1.02 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.584 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 2.23 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.668 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 1.02 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.692 HG21 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.99 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.99 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.632 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 1.02 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.437 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 111.939 -0.464 . . . . 22.71 111.939 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -134.75 84.66 2.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.967 -0.383 . . . . 23.63 109.967 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtt -127.83 -69.05 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 22.32 110.932 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -133.61 63.61 1.63 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 20.7 110.15 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.48 -25.75 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.953 0.406 . . . . 18.63 110.908 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 38.71 22.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.442 -0.799 . . . . 16.83 110.843 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -61.51 -29.21 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.594 -0.73 . . . . 17.9 111.556 -174.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -64.48 -26.62 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.386 -0.37 . . . . 15.17 111.115 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.8 m -104.99 -63.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.092 0.473 . . . . 13.97 110.463 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtpt -78.95 81.93 5.18 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.678 -0.692 . . . . 15.02 109.525 -177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.19 69.34 0.77 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.763 -1.108 . . . . 13.16 111.118 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.04 100.28 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.199 -0.91 . . . . 10.53 109.663 175.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -125.53 -62.4 1.2 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.234 -0.439 . . . . 10.66 110.494 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -165.66 -51.82 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.217 -0.447 . . . . 7.72 111.129 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 p -172.35 79.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.019 0.438 . . . . 6.27 110.36 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -94.08 -64.86 1.03 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.064 -0.516 . . . . 6.79 110.088 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 p -162.41 -90.66 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 3.15 110.315 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.502 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 5.9 p -157.13 -81.78 0.06 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.823 0.82 . . . . 1.91 109.67 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.598 ' C ' ' HB3' ' A' ' 65' ' ' SER . 12.5 m 63.25 152.34 0.04 OUTLIER 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 113.307 -1.77 . . . . 1.32 112.353 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.575 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -92.39 -167.0 1.66 Allowed 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 114.649 -1.16 . . . . 1.12 111.743 -173.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 3.5 m-80 -114.03 141.12 47.83 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 106.048 -1.834 . . . . 0.43 106.048 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.682 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 0.5 OUTLIER -75.34 -11.34 60.03 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 119.421 -0.912 . . . . 1.0 110.348 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 p -82.6 -8.56 59.6 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 108.445 -0.946 . . . . 1.88 108.445 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.578 ' OD1' ' HB3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -94.68 -54.35 3.53 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 123.03 1.395 . . . . 1.27 108.72 173.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.682 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 55.5 t -72.17 -44.66 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 CA-C-N 111.956 -2.384 . . . . 1.65 110.86 -163.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.507 ' CE1' HD12 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.14 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.662 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 1.05 110.911 -176.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.621 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 1.26 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.683 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.87 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 1.04 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.667 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.52 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.66 HG23 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 1.01 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.523 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.95 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.523 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.81 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 1.28 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.439 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 1.01 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.599 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 1.04 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.555 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 1.02 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 2.38 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.897 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.81 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.6 mm100 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.88 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.5 ' CE2' HG23 ' A' ' 82' ' ' ILE . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.17 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.559 ' CD ' HD13 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 2.11 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.607 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 1.03 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.76 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.654 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.507 HD12 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 1.02 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 1.44 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.675 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.99 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 1.05 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.656 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 1.0 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.692 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.675 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 2.42 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 1.01 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.692 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.598 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.63 109.432 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.523 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.67 110.636 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.575 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.672 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 38.7 t-80 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.19 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 1.09 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 1.05 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.49 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 1.05 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.639 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.97 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.87 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.65 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 1.03 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.639 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.588 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.68 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 1.01 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.97 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 1.04 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.588 ' HB3' HD21 ' A' ' 124' ' ' LEU . 39.6 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.607 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 1.02 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 1.59 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.596 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 1.0 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.63 HG22 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 1.0 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.609 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.521 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 1.02 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.609 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 1.04 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.68 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.757 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.674 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 3.37 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.17 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.538 ' HB3' HD13 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.99 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.63 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 1.03 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.897 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 1.04 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.66 ' C ' HG23 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.599 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 1.03 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 1.02 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.653 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 1.01 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 1.31 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 1.02 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.674 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 2.48 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 1.03 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.65 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 1.06 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.92 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.68 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.98 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.78 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.701 ' CG ' HG21 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 1.05 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.462 HG23 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 1.03 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 2.41 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.548 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.9 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.528 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.841 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 1.06 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.779 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 1.03 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.5 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.841 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.9 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.779 HG22 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 1.03 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 1.02 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.594 ' C ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 2.23 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.757 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 1.02 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.701 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.99 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.99 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 1.02 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.106 -0.398 . . . . 22.71 112.106 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -98.87 29.76 3.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 23.63 111.116 -177.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ptm -133.67 32.74 3.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.056 0.455 . . . . 22.32 110.665 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -76.18 142.62 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.757 -0.46 . . . . 20.7 109.757 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.4 m -79.23 112.91 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.625 0.726 . . . . 18.63 111.057 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' HB3' ' HB ' ' A' ' 9' ' ' THR . . . -84.67 60.67 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.551 -0.75 . . . . 16.83 110.403 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -66.19 -19.18 65.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.465 -0.789 . . . . 17.9 112.209 -173.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.5 m -122.9 25.1 8.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.056 0.455 . . . . 15.17 110.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.442 ' HB ' ' HB3' ' A' ' 6' ' ' ALA . 4.0 m -115.39 168.35 10.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.713 -0.477 . . . . 13.97 109.713 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 71.37 28.62 2.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 121.844 0.831 . . . . 15.02 110.188 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -127.7 109.89 12.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.599 -0.728 . . . . 13.16 110.152 177.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.75 90.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.567 0.698 . . . . 10.53 110.1 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 14' ' ' THR . 45.0 mt-10 -125.25 -163.92 1.24 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.548 -0.751 . . . . 10.66 110.518 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 16' ' ' GLN . 44.0 m 76.89 -51.93 0.57 Allowed 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.983 0.802 . . . . 7.72 111.941 173.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.7 m -77.54 39.92 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.151 0.501 . . . . 6.27 111.179 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 14' ' ' THR . 22.5 tp60 -133.9 1.52 3.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.402 0.62 . . . . 6.79 109.71 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.502 ' C ' ' H ' ' A' ' 19' ' ' THR . 22.0 t -170.82 -168.6 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 3.15 108.965 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.623 ' O ' ' HA ' ' A' ' 65' ' ' SER . 7.0 t -87.2 22.69 2.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.37 1.081 . . . . 1.91 109.589 176.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.535 ' HA ' ' CG ' ' A' ' 66' ' ' ARG . 16.9 m -37.79 143.2 0.12 Allowed 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 112.528 -2.123 . . . . 1.32 114.009 -177.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.549 ' CB ' HD13 ' A' ' 62' ' ' LEU . . . -71.54 177.85 3.82 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.295 -1.775 . . . . 1.12 111.758 -178.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 6.8 m-80 -112.15 156.5 22.17 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.472 -1.694 . . . . 0.43 107.674 -176.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.583 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -77.31 -12.42 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 119.788 -0.765 . . . . 1.0 110.376 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.0 m -79.59 -12.41 59.84 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.213 -1.032 . . . . 1.88 108.213 171.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.593 ' HB3' HD12 ' A' ' 62' ' ' LEU . 51.6 m-20 -97.18 -47.67 5.66 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.341 -1.299 . . . . 1.27 108.948 175.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.583 ' HB ' HE21 ' A' ' 22' ' ' GLN . 53.7 t -85.51 -53.15 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 113.267 -1.788 . . . . 1.65 113.251 -164.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.14 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.58 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 1.05 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 1.26 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.588 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.87 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 1.04 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.704 ' CG ' HD13 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.686 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.52 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.678 HG22 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 1.01 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.572 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.95 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.572 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.81 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.576 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 1.28 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.579 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 1.01 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 1.04 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 1.02 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HG2' HG21 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 2.38 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.81 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.619 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.88 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.569 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.17 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 2.11 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 1.03 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.76 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.634 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.503 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 1.02 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.619 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 1.44 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.685 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.99 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.795 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 1.05 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.557 HD23 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 1.0 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.674 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 2.42 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 1.01 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.674 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.623 ' HA ' ' O ' ' A' ' 18' ' ' THR . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.63 109.056 178.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.587 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.67 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.587 ' OE2' ' HG3' ' A' ' 66' ' ' ARG . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.658 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 27.6 t-80 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.19 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 1.09 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.782 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 1.05 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.497 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 1.05 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.722 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.97 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.87 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.65 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 1.03 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.722 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.68 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.704 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 1.01 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.723 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.97 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 1.04 110.544 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.578 ' HA ' ' CG2' ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.636 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 1.02 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 1.59 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 1.0 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.622 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 1.0 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.569 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 1.02 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.694 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.52 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 1.04 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.662 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 3.37 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.694 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.17 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.531 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.99 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.622 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 1.03 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 1.04 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.678 ' C ' HG22 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.605 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 1.03 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.583 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 1.02 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.519 ' HB3' ' HB3' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.633 ' HA ' HD22 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 1.01 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 1.31 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 1.02 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 2.48 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.49 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 1.03 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 1.06 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.92 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.98 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.52 ' HB3' ' HZ3' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.78 108.094 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.701 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 1.05 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.456 HG22 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 1.03 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 2.41 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.578 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.9 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.579 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.79 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 1.06 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.803 ' O ' HG22 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 1.03 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.51 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.79 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.9 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.803 HG22 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 1.03 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 1.02 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.583 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 2.23 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.662 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 1.02 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.701 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.99 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.99 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 1.02 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.49 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 112.25 -0.34 . . . . 22.71 112.25 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -60.32 -50.46 73.53 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.041 0.386 . . . . 23.63 112.041 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.5 mmt -77.35 -50.81 11.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.85 -0.34 . . . . 22.32 110.503 -177.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -143.24 153.28 42.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 20.7 110.17 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.447 HG13 ' OG ' ' A' ' 8' ' ' SER . 12.6 t -117.14 73.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.405 0.622 . . . . 18.63 109.698 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.29 -13.23 20.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.746 -0.661 . . . . 16.83 111.309 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.89 -4.57 44.48 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.794 0.294 . . . . 17.9 111.794 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.447 ' OG ' HG13 ' A' ' 5' ' ' VAL . 9.7 m -50.73 -53.48 31.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.198 0.444 . . . . 15.17 112.198 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.6 m -104.56 21.37 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.341 0.591 . . . . 13.97 110.535 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -103.15 63.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.153 0.501 . . . . 15.02 109.956 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -113.44 127.36 56.08 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.821 -0.627 . . . . 13.16 110.022 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.62 112.78 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.125 -0.489 . . . . 10.53 109.842 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.53 -56.33 1.89 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.831 -0.622 . . . . 10.66 110.011 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 t -116.4 125.27 51.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.571 -0.741 . . . . 7.72 110.063 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.411 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 13.6 m -119.56 127.23 52.8 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.722 -0.473 . . . . 6.27 109.722 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 15' ' ' SER . 7.2 tt0 69.54 128.55 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.845 0.715 . . . . 6.79 110.903 -177.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 m -70.54 167.54 18.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 3.15 110.947 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.419 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 27.3 p -51.57 149.76 4.22 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.335 0.865 . . . . 1.91 113.335 -176.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.518 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 6.7 m -140.86 148.03 39.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.685 -0.688 . . . . 1.32 109.775 175.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.56 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -77.27 -176.22 4.03 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 122.312 1.053 . . . . 1.12 112.258 -174.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.5 m-80 -120.9 150.12 41.56 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.405 -1.725 . . . . 0.43 107.213 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.556 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -75.54 -11.95 60.13 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.412 -0.515 . . . . 1.0 111.27 -178.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -81.67 -12.93 58.47 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 108.412 -0.959 . . . . 1.88 108.412 170.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.523 ' HB3' HD11 ' A' ' 62' ' ' LEU . 93.1 m-20 -97.94 -43.1 7.23 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.119 -1.4 . . . . 1.27 109.456 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.556 ' HB ' HE21 ' A' ' 22' ' ' GLN . 70.3 t -88.46 -55.45 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.032 -1.44 . . . . 1.65 112.65 -167.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.567 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.14 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.66 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 1.05 111.015 -176.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.718 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 1.26 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.87 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.53 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 1.04 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.718 ' HD2' ' O ' ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.614 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.52 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 1.01 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.593 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.95 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.593 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.81 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.448 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 1.28 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.788 HG21 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 1.01 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.714 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 1.04 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.602 HD21 ' CG2' ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 1.02 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 2.38 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.81 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.1 mm100 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.88 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.57 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.17 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.645 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 2.11 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.628 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 1.03 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.76 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.747 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.9 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 1.02 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.649 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 1.44 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.612 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.99 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.8 ' O ' HD21 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 1.05 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.536 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 1.0 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 2.42 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.8 HD21 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 1.01 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.533 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.63 109.312 178.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.518 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.67 110.784 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.56 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.643 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 28.7 t-80 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.19 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 1.09 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.781 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 1.05 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.475 ' N ' HD11 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 1.05 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.658 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.97 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.87 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.65 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 1.03 110.584 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.658 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.68 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.692 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 1.01 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.97 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.408 HG21 HG21 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 1.04 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HB3' HD21 ' A' ' 124' ' ' LEU . 44.5 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.628 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 1.02 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 1.59 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 1.0 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.624 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 1.0 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.771 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 1.8 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 1.02 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.692 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.771 ' HB1' ' O ' ' A' ' 86' ' ' GLN . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 1.04 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.7 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.668 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 3.37 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.692 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.17 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.534 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.99 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.624 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 1.03 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 1.04 109.412 -175.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.714 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 1.03 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.59 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 1.02 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.493 ' HB3' ' HB3' ' A' ' 106' ' ' ALA . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.648 ' HA ' HD22 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 1.01 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 1.31 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 1.02 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.668 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 2.48 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.444 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 1.03 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 1.06 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.92 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.484 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.7 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.98 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.78 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.668 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 1.05 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.477 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 1.03 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 2.41 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.546 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.9 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 1.06 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.788 ' OE2' HG21 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.739 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 1.03 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.501 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.9 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 1.03 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 1.02 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.59 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 2.23 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 1.02 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.668 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.99 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.99 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.648 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 1.02 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.81 -0.516 . . . . 22.71 111.81 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -136.38 139.14 42.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.721 0.296 . . . . 23.63 110.223 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.4 tpt -106.17 124.06 48.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.314 -0.403 . . . . 22.32 110.256 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -100.62 96.59 7.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.221 -0.445 . . . . 20.7 110.477 -177.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.0 t -102.53 -58.55 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.094 0.473 . . . . 18.63 110.339 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.27 70.28 0.3 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.608 -0.724 . . . . 16.83 109.902 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 17.9 110.461 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m 69.87 133.67 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.926 0.766 . . . . 15.17 112.635 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 m -75.93 153.6 36.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.628 -0.714 . . . . 13.97 110.306 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp 75.01 2.57 4.01 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.352 0.661 . . . . 15.02 110.306 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 70.16 147.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.11 -0.95 . . . . 13.16 111.727 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.0 mt -85.03 94.03 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.68 -0.691 . . . . 10.53 110.14 178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.62 -77.0 0.53 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.861 0.362 . . . . 10.66 111.089 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -94.71 -81.53 0.39 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.006 -0.543 . . . . 7.72 111.648 -175.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.9 m 55.82 41.03 30.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.424 0.631 . . . . 6.27 109.961 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -80.39 -57.47 3.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 6.79 111.129 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -140.76 -166.24 2.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.881 0.372 . . . . 3.15 111.06 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.572 ' OG1' ' HA ' ' A' ' 65' ' ' SER . 2.9 p -68.18 172.1 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.709 . . . . 1.91 112.027 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.55 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 91.9 m -128.78 -71.95 0.62 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.736 -0.665 . . . . 1.32 110.511 173.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.556 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . 175.4 -173.21 0.08 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 124.414 1.071 . . . . 1.12 112.114 176.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.517 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.7 m-80 -134.63 148.4 50.38 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 112.91 -1.95 . . . . 0.43 106.152 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.595 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -79.75 -13.09 59.69 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 119.862 -0.735 . . . . 1.0 111.496 -176.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.7 t -82.47 -9.6 59.36 Favored 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 107.625 -1.25 . . . . 1.88 107.625 171.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HB3' HD11 ' A' ' 62' ' ' LEU . 94.7 m-20 -98.6 -44.06 6.6 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.282 -1.326 . . . . 1.27 109.385 176.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.595 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 53.8 t -86.9 -53.5 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.182 -1.372 . . . . 1.65 113.145 -170.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.613 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.14 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.534 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 1.05 110.801 -175.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 1.26 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.696 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.87 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 1.04 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.708 ' CG ' HD13 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.672 ' CZ ' HD21 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.52 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 1.01 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.604 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.95 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.604 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.81 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 1.28 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.501 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 1.01 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.62 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 1.04 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.578 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 1.02 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 2.38 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.81 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 11.0 mm100 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.88 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.588 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.17 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.545 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 2.11 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.617 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 1.03 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.76 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.632 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.493 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 1.02 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.596 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 1.44 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.679 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.99 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 1.05 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 1.0 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.687 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 2.42 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 1.01 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.687 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.572 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.63 110.113 177.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.55 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.67 110.268 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.556 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.0 t-80 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.19 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 1.09 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.772 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 1.05 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.482 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 1.05 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.648 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.97 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.42 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.87 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.772 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.65 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 1.03 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.648 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.68 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.708 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 1.01 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.97 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 1.04 110.622 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.576 ' HA ' ' CG2' ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.617 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 1.02 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 1.59 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 1.0 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.632 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 1.0 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.808 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.8 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.605 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 1.02 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.808 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 1.04 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.669 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.689 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.67 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 3.37 107.334 173.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.17 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.539 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.99 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.632 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 1.03 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 1.04 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.682 ' C ' HG23 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.62 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 1.03 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.583 HD22 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 1.02 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.623 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 1.01 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 1.31 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.5 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 1.02 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.67 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 2.48 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 1.03 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.625 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 1.06 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.92 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.669 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.98 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.78 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.699 ' CG ' HG22 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 1.05 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.444 HG23 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 1.03 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 2.41 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.576 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.9 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.781 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 1.06 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG21 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 1.03 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.506 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.781 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.9 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.795 HG21 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 1.03 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 1.02 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.583 ' C ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 2.23 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.689 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 1.02 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.699 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.99 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.99 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 1.02 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.845 -0.502 . . . . 22.71 111.845 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -90.28 -30.64 17.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.905 0.383 . . . . 23.63 110.335 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -138.42 -72.48 0.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.325 -0.398 . . . . 22.32 110.868 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 52.4 56.88 7.06 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.408 0.623 . . . . 20.7 110.394 -175.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.3 m -112.84 38.07 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.348 -0.842 . . . . 18.63 110.542 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.33 39.55 2.47 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.633 -0.712 . . . . 16.83 110.236 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -93.94 -6.74 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.602 -0.726 . . . . 17.9 110.944 -177.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.9 m -85.03 54.92 3.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.326 0.584 . . . . 15.17 109.863 177.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.2 p -81.22 154.92 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.581 -0.736 . . . . 13.97 111.872 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -99.4 13.2 34.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.566 -0.743 . . . . 15.02 110.129 178.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -96.68 159.86 14.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 13.16 109.375 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.3 mt -85.64 104.53 13.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.775 -0.454 . . . . 10.53 109.775 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -124.75 166.42 16.22 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.128 -0.487 . . . . 10.66 110.36 -177.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.4 m 69.48 125.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.81 0.694 . . . . 7.72 110.799 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t 65.69 68.21 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.252 0.549 . . . . 6.27 110.289 -178.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -66.58 131.95 47.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 6.79 109.828 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.6 m -75.86 178.47 6.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.327 -0.397 . . . . 3.15 111.143 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.2 p -51.61 135.36 28.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.686 -0.688 . . . . 1.91 111.977 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.53 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 50.3 m -127.0 147.75 50.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.2 0.524 . . . . 1.32 110.205 177.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.589 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -76.76 169.59 18.02 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 122.339 1.066 . . . . 1.12 111.612 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.563 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.7 m-80 -107.9 145.09 34.23 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.113 -1.858 . . . . 0.43 106.634 -176.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.492 ' NE2' HG11 ' A' ' 25' ' ' VAL . 1.2 mp0 -69.81 -14.19 62.64 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 119.237 0.926 . . . . 1.0 111.25 -176.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.3 p -79.48 -7.44 58.44 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 108.174 -1.047 . . . . 1.88 108.174 170.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' A' ' 21' ' ' ASN . 82.0 m-20 -98.75 -49.25 4.65 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.532 -1.213 . . . . 1.27 108.411 174.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.503 HG13 ' HG3' ' A' ' 67' ' ' GLU . 1.7 m -91.22 -41.24 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.874 -1.057 . . . . 1.65 113.54 -166.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.581 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.14 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.577 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 1.05 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.589 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 1.26 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.698 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.87 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 1.04 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.625 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.52 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.676 HG22 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 1.01 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.95 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.42 ' O ' HG21 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.81 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.422 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 1.28 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.468 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 1.01 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.61 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 1.04 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.559 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 1.02 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG21 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 2.38 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.893 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.81 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 15.1 mm100 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.88 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.495 ' CE2' HG23 ' A' ' 82' ' ' ILE . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.17 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.539 ' HD2' HD12 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 2.11 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 1.03 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.76 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.653 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.485 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 1.02 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.617 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 1.44 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.99 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD23 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 1.05 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 1.0 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.665 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 2.42 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.784 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 1.01 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.665 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.549 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.63 109.582 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.53 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.67 112.348 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.589 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.606 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.8 t-80 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.19 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 1.09 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 1.05 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.482 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 1.05 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.97 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.87 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.65 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 1.03 110.776 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.647 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.583 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.68 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 1.01 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.97 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 1.04 110.6 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.582 ' HB3' HD23 ' A' ' 124' ' ' LEU . 40.0 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 1.02 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 1.59 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.617 HG21 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 1.0 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.578 ' HG3' HD13 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.557 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 1.02 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.695 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 1.04 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.706 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.689 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.669 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 3.37 109.17 169.643 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.695 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.17 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.536 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.99 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.617 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 1.03 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.893 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 1.04 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.676 ' C ' HG22 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.61 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 1.03 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.576 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 1.02 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.476 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.643 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 1.01 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 1.31 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 1.02 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.669 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 2.48 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.518 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 1.03 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 1.06 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.92 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.706 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.98 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.78 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.679 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 1.05 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 1.03 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 2.41 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.579 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.9 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 1.06 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 1.03 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.522 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.9 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 1.03 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 1.02 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 127' ' ' VAL . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 2.23 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.689 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 1.02 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.679 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.99 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.99 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 1.02 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.518 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.999 -0.44 . . . . 22.71 111.999 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -93.07 72.38 4.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 23.63 110.781 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 mmt 58.12 40.89 24.67 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.83 -0.623 . . . . 22.32 111.603 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -150.46 101.5 2.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.572 -0.74 . . . . 20.7 109.166 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.61 132.21 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.338 -0.846 . . . . 18.63 112.286 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.39 40.12 27.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.302 -0.863 . . . . 16.83 112.203 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -85.77 -34.16 21.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.942 0.401 . . . . 17.9 110.146 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -147.35 124.72 11.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.142 -0.481 . . . . 15.17 110.634 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -144.3 168.65 19.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.006 -0.739 . . . . 13.97 109.006 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.555 ' HG3' ' H ' ' A' ' 11' ' ' GLU . 47.0 pttt -57.16 -65.09 0.68 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.332 0.11 . . . . 15.02 111.084 -178.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.555 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 4.5 mm-40 -158.12 152.85 24.95 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.169 -0.678 . . . . 13.16 109.169 178.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.8 mt -112.82 73.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.23 0.538 . . . . 10.53 109.823 175.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -138.27 48.37 1.96 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.898 -0.592 . . . . 10.66 110.303 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.2 p -64.52 -66.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.683 -0.488 . . . . 7.72 109.683 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.9 m 50.03 42.36 24.61 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.693 0.62 . . . . 6.27 112.334 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -93.86 -40.59 10.08 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.475 0.655 . . . . 6.79 109.374 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 t -155.39 -72.32 0.12 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.034 -0.984 . . . . 3.15 108.593 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.693 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 5.6 p -154.83 145.8 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.945 -1.025 . . . . 1.91 109.003 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 19' ' ' THR . 12.5 m -136.81 22.17 3.09 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.658 1.218 . . . . 1.32 109.908 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.526 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . . . 67.41 -176.95 0.2 Allowed 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.245 -1.798 . . . . 1.12 111.827 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -123.36 155.35 37.51 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.891 -1.504 . . . . 0.43 107.356 -176.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.594 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -76.89 -11.81 59.87 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 119.89 -0.724 . . . . 1.0 110.771 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.5 m -82.19 -11.35 58.75 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.454 -0.943 . . . . 1.88 108.454 171.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.592 ' HB3' HD12 ' A' ' 62' ' ' LEU . 85.2 m-20 -97.95 -45.83 6.14 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.479 -1.237 . . . . 1.27 109.302 175.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.594 ' HB ' HE21 ' A' ' 22' ' ' GLN . 42.6 t -85.7 -50.4 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 CA-C-N 113.129 -1.85 . . . . 1.65 112.491 -167.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.544 ' HA ' HD12 ' A' ' 58' ' ' LEU . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.472 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 1.05 111.186 -173.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.568 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 1.26 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.732 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.87 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 1.04 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.729 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.658 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.52 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.661 HG23 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 1.01 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.432 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.95 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.81 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 1.28 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.601 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 1.01 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.561 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 1.04 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.572 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 1.02 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 2.38 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.65 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.81 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 10.2 mm100 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.88 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.522 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.17 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 2.11 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.604 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 1.03 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.76 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.617 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.421 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 1.02 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.683 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.99 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.787 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 1.05 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.57 HD12 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 1.0 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 2.42 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.787 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 1.01 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.584 ' HA ' ' CB ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.63 109.905 177.767 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.693 ' HB3' ' O ' ' A' ' 18' ' ' THR . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.67 110.154 176.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.526 ' HB2' ' HB3' ' A' ' 20' ' ' ALA . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.64 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.6 t-80 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.19 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 1.09 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.737 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 1.05 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.51 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 1.05 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.97 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.87 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.65 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.59 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 1.03 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.624 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.68 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.729 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 1.01 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.97 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 1.04 110.808 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.572 ' HB3' HD22 ' A' ' 124' ' ' LEU . 37.3 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.604 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 1.02 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 1.59 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 1.0 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.638 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 1.0 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.696 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.8 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG12 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 1.02 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.674 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 1.04 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.683 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.681 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.667 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 3.37 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.674 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.17 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.99 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.638 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 1.03 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.65 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 1.04 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.661 ' C ' HG23 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.561 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 1.03 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.578 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 1.02 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.474 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.633 ' HA ' HD22 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 1.01 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 1.31 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.427 ' HB2' ' HB3' ' A' ' 103' ' ' ASP . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 1.02 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.667 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 2.48 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.512 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 1.03 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.641 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 1.06 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.92 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 109' ' ' LYS . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.683 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.98 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.78 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.699 ' CG ' HG21 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.405 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 1.05 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.492 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 1.03 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 2.41 109.869 169.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.54 ' HB ' ' HG3' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.9 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.601 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.841 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 1.06 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.789 ' O ' HG22 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 1.03 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.631 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.841 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.9 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.789 HG22 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 1.03 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 1.02 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.578 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 2.23 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.681 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 1.02 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.699 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.99 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.99 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.633 HD22 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 1.02 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.512 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.927 -0.469 . . . . 22.71 111.927 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 m80 56.42 43.27 26.37 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.404 0.621 . . . . 23.63 111.008 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.9 ttm -134.57 -32.13 1.03 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.297 -0.865 . . . . 22.32 109.665 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -91.83 62.23 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.508 0.671 . . . . 20.7 109.554 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.05 95.78 5.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.132 -0.692 . . . . 18.63 109.132 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.66 41.7 0.57 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.855 -0.611 . . . . 16.83 112.129 -171.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 -91.11 -14.61 30.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.3 0.571 . . . . 17.9 109.569 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.6 p -111.58 132.69 54.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.441 -0.799 . . . . 15.17 110.903 -178.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -83.92 -30.89 25.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.098 -0.501 . . . . 13.97 110.716 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -144.21 9.25 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 15.02 110.826 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 71.09 138.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.465 -0.789 . . . . 13.16 110.65 -177.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -73.07 103.35 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.091 -0.504 . . . . 10.53 110.427 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -127.81 -71.36 0.66 Allowed 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.111 -0.495 . . . . 10.66 110.613 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.6 m -102.57 83.83 2.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.507 0.67 . . . . 7.72 111.336 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 6.4 p -99.56 12.2 37.12 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.811 0.815 . . . . 6.27 108.943 172.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -101.83 133.69 46.19 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.703 -1.135 . . . . 6.79 110.845 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 m -67.95 -176.94 0.74 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.795 -0.639 . . . . 3.15 111.062 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.416 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 11.4 p -49.68 133.13 21.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.919 0.39 . . . . 1.91 111.416 177.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.479 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.6 m -143.98 149.85 37.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.304 0.573 . . . . 1.32 111.061 -176.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.542 ' CB ' ' HB2' ' A' ' 67' ' ' GLU . . . -81.39 178.1 8.57 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 122.205 1.002 . . . . 1.12 112.146 -173.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 13.1 m-80 -119.74 153.59 35.42 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.316 -1.766 . . . . 0.43 107.529 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.6 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -76.79 -13.15 60.05 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 120.023 -0.671 . . . . 1.0 111.027 -179.056 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -80.34 -12.81 59.55 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.014 -1.106 . . . . 1.88 108.014 171.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HB3' HD13 ' A' ' 62' ' ' LEU . 83.5 m-20 -97.38 -44.67 6.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.287 -1.324 . . . . 1.27 109.072 177.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.6 ' HB ' HE21 ' A' ' 22' ' ' GLN . 55.8 t -87.19 -53.19 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 113.434 -1.712 . . . . 1.65 112.994 -167.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.549 ' HA ' HD13 ' A' ' 58' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.14 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.405 ' ND2' HG12 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.452 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 1.05 111.166 -174.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.648 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 1.26 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.87 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.548 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 1.04 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD12 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.607 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.52 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.684 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 1.01 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.95 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.81 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.464 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 1.28 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.758 HG23 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 1.01 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.695 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 1.04 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.565 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 1.02 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 2.38 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.81 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.9 mm100 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.88 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.555 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.17 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.612 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 2.11 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.613 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 1.03 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.76 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.648 ' HG2' ' CD2' ' A' ' 31' ' ' LEU . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.464 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 1.02 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.646 ' HG2' ' HH ' ' A' ' 75' ' ' TYR . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 1.44 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.677 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.99 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 1.05 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.542 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.709 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 2.42 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.788 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 1.01 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.709 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.479 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.63 109.796 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.45 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.67 111.443 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.542 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.667 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.8 t-80 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.19 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 1.09 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.709 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 1.05 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.516 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 1.05 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.97 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.87 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.65 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.646 ' HH ' ' HG2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 1.03 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.68 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 1.01 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.719 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.97 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 1.04 110.586 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.59 ' HB3' HD22 ' A' ' 124' ' ' LEU . 42.1 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.613 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 1.02 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.719 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 1.59 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 1.0 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.675 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.607 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 1.02 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.668 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 1.04 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.673 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.655 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 3.37 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.668 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.17 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.522 ' HB2' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.99 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.648 ' HB ' HG21 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 1.03 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 1.04 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.684 ' C ' HG23 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.695 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 1.03 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.582 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 1.02 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.51 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.626 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 1.01 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 1.31 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 1.02 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.655 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 2.48 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.5 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 1.03 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.517 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 1.06 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.92 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.452 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.98 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.78 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG21 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 1.05 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.456 HG23 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 1.03 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 2.41 109.609 169.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.546 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.9 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 1.06 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.758 ' OE2' HG23 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 1.03 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.9 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 1.03 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 1.02 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.582 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 2.23 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.673 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 1.02 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.695 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.99 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.99 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.626 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 1.02 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.5 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.874 -0.491 . . . . 22.71 111.874 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -111.15 119.79 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.437 -0.579 . . . . 23.63 109.437 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.7 mmt 71.12 106.23 0.06 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.14 0.9 . . . . 22.32 110.186 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -55.79 148.24 17.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 20.7 111.189 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.7 m -73.87 60.65 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.744 -0.662 . . . . 18.63 112.215 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.96 27.71 1.14 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.305 0.574 . . . . 16.83 110.391 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 78.8 mtp180 -94.21 2.53 55.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.446 -0.797 . . . . 17.9 110.259 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.7 m -54.94 131.2 44.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.7 -0.682 . . . . 15.17 111.886 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.7 m 69.33 66.72 0.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.383 -0.826 . . . . 13.97 111.573 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 7' ' ' ARG . 72.9 mmtt -91.91 -22.92 19.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.821 -0.627 . . . . 15.02 109.687 172.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.84 173.55 6.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.443 -0.799 . . . . 13.16 109.017 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.2 mt -84.07 71.91 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.605 0.717 . . . . 10.53 110.318 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -140.7 143.47 35.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.429 -0.805 . . . . 10.66 109.913 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 m 64.38 11.81 6.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.52 0.676 . . . . 7.72 110.821 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 p -87.79 -7.13 57.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.09 -0.505 . . . . 6.27 111.468 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -70.25 -78.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.827 0.346 . . . . 6.79 110.445 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.4 m -157.93 76.3 0.79 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.417 -0.586 . . . . 3.15 109.417 177.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.0 p 57.8 164.92 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 124.276 0.985 . . . . 1.91 112.643 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.562 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 26.1 m -152.49 146.69 25.46 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.338 0.59 . . . . 1.32 110.428 177.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 67' ' ' GLU . . . -80.34 179.5 7.65 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.213 1.006 . . . . 1.12 111.367 -176.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.553 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 9.7 m-80 -117.12 144.16 45.0 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 106.216 -1.772 . . . . 0.43 106.216 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.485 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 1.2 mp0 -67.95 -15.0 63.41 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 119.437 1.017 . . . . 1.0 111.005 -178.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -78.72 -8.0 58.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 108.428 -0.953 . . . . 1.88 108.428 171.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 21' ' ' ASN . 78.2 m-20 -99.02 -49.54 4.48 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.44 -1.255 . . . . 1.27 108.475 174.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 67' ' ' GLU . 1.9 m -89.51 -41.39 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-N 114.768 -1.105 . . . . 1.65 113.133 -166.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.581 ' HA ' HD13 ' A' ' 58' ' ' LEU . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.578 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.4 ' O ' ' HB1' ' A' ' 34' ' ' ALA . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 1.05 111.051 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.616 ' O ' ' HD2' ' A' ' 35' ' ' PHE . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 1.26 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.582 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.87 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 1.04 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.632 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.52 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.679 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 1.01 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.557 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.95 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.557 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.81 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.458 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 1.28 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.433 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 1.01 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.598 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 1.04 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.57 HD23 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 1.02 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.455 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 2.38 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.674 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.81 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.517 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.9 mm100 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.88 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.52 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.17 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' CD ' HD13 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 2.11 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.612 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 1.03 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.76 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.612 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.473 ' HG ' ' CE2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 1.02 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.563 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 1.44 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.656 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.99 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD23 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 1.05 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.599 HD11 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 1.0 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.644 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.656 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 2.42 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.778 HD23 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 1.01 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.55 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.63 109.192 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.562 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.67 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.586 ' OE1' HD11 ' A' ' 70' ' ' LEU . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.599 ' NE2' HD11 ' A' ' 59' ' ' LEU . 26.2 t-80 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.19 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 1.09 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.754 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 1.05 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.501 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 1.05 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.61 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.97 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.87 109.843 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.754 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.65 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 1.03 110.826 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.68 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 1.01 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.704 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.97 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 1.04 110.634 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.587 ' HB3' HD22 ' A' ' 124' ' ' LEU . 40.3 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.612 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 1.02 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.704 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 1.59 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 1.0 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.625 HG22 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 1.0 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.663 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.461 ' O ' ' HB1' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 1.02 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.663 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 1.04 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.715 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.679 ' CE2' ' HB2' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 3.37 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.17 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.515 ' HB1' HD13 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.99 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.625 ' HB ' HG22 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 1.03 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.674 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 1.04 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.679 ' C ' HG23 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.598 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 1.03 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.572 HD23 ' C ' ' A' ' 130' ' ' LYS . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 1.02 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.615 ' HA ' HD23 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 1.01 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 1.31 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.414 ' HB1' ' HB3' ' A' ' 103' ' ' ASP . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 1.02 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 2.48 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 1.03 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 1.06 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.92 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.715 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.98 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.78 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG22 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 1.05 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.476 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 1.03 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 2.41 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.554 ' CG2' ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.9 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 1.06 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG21 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.767 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 1.03 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.502 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.9 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.778 HG21 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 1.03 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 1.02 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.572 ' C ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 2.23 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.679 ' HB2' ' CE2' ' A' ' 92' ' ' PHE . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 1.02 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG22 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.99 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.426 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.99 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 1.02 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.802 -0.519 . . . . 22.71 111.802 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 71.4 t60 63.66 52.11 2.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.549 0.69 . . . . 23.63 110.354 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -86.17 55.29 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 22.32 110.148 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -140.98 152.06 44.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 20.7 110.073 -174.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.94 -22.36 2.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.688 0.28 . . . . 18.63 111.562 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.95 40.43 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.181 0.515 . . . . 16.83 110.478 -178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -77.72 -58.44 3.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.948 -0.569 . . . . 17.9 110.674 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.2 m 53.61 75.41 0.26 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.639 0.587 . . . . 15.17 110.215 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.1 m -67.26 88.83 0.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.844 -0.616 . . . . 13.97 111.095 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -121.38 111.22 17.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.523 -0.762 . . . . 15.02 109.428 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 45.3 mt-10 -60.18 116.12 3.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.51 -0.314 . . . . 13.16 110.909 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.434 HD11 ' H ' ' A' ' 12' ' ' ILE . 3.9 mp -73.28 110.07 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 109.735 -0.468 . . . . 10.53 109.735 174.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 15.5 mt-10 -124.01 -57.61 1.6 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.589 -0.732 . . . . 10.66 110.309 -175.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -84.01 129.32 34.92 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.425 -0.807 . . . . 7.72 109.569 176.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 p -53.8 119.13 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.376 0.422 . . . . 6.27 110.563 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -78.19 144.16 36.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.607 0.717 . . . . 6.79 112.379 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.9 t -149.57 144.12 26.02 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.707 -1.133 . . . . 3.15 108.158 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 55.6 p 47.79 -92.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.075 0.86 . . . . 1.91 111.933 -178.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.622 ' C ' ' HB3' ' A' ' 65' ' ' SER . 14.5 m 71.84 150.78 0.1 Allowed 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.484 -1.235 . . . . 1.32 111.978 177.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.643 ' CB ' HD11 ' A' ' 62' ' ' LEU . . . -91.54 -171.43 2.91 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-N 114.224 -1.353 . . . . 1.12 112.375 -167.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -108.55 131.47 54.81 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 105.749 -1.945 . . . . 0.43 105.749 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.735 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -70.21 -11.39 60.86 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.089 -0.644 . . . . 1.0 109.343 177.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 p -80.09 -8.67 59.51 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 115.141 -0.936 . . . . 1.88 108.677 171.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.616 ' OD2' ' HB2' ' A' ' 61' ' ' LYS . 18.3 t70 -97.08 -59.82 1.71 Allowed 'General case' 0 N--CA 1.416 -2.127 0 CA-C-O 123.225 1.488 . . . . 1.27 110.392 165.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.735 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 54.1 t -61.46 -42.72 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.594 0 CA-C-N 110.918 -2.856 . . . . 1.65 111.134 -156.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.579 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.14 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.581 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 1.05 110.953 -175.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.61 ' CD2' ' HG2' ' A' ' 54' ' ' GLN . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 1.26 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.709 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.87 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 48' ' ' GLN . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 1.04 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD12 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD22 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.52 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.671 HG23 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 1.01 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.534 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.95 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.534 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.81 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.403 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 1.28 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 1.01 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.626 ' CB ' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 1.04 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.56 HD21 ' CG2' ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 1.02 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 2.38 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.899 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.81 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 13.7 mm100 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.88 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.498 ' CE2' HG22 ' A' ' 82' ' ' ILE . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.17 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.561 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 2.11 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 1.03 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.76 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.661 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 1.02 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 1.44 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.661 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.99 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.655 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 1.05 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.579 ' O ' ' HD2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.803 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 57' ' ' THR . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 2.42 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.684 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 1.01 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.803 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.622 ' HB3' ' C ' ' A' ' 19' ' ' THR . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.63 109.294 178.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.591 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.67 110.526 178.13 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.632 ' HB2' ' CB ' ' A' ' 20' ' ' ALA . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.684 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.9 t-80 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.19 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 1.09 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 1.05 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.471 ' N ' HD12 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 1.05 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.97 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.87 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.65 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 1.03 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.622 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.601 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.68 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.737 HD12 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 1.01 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.713 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.97 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 1.04 110.654 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.562 ' HB3' HD23 ' A' ' 124' ' ' LEU . 48.5 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.599 HG12 ' HG ' ' A' ' 52' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 1.02 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.713 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 1.59 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 1.0 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.623 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 1.0 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.583 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 1.02 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.678 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 1.04 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.718 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.673 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.665 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.544 ' HZ2' ' HB3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 3.37 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.678 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.17 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.513 ' HB2' HD11 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.99 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.623 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 1.03 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.899 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 1.04 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.671 ' C ' HG23 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.626 ' HA3' ' CB ' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 1.03 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.6 HD21 ' C ' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 1.02 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.486 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.63 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 1.01 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 1.31 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 1.02 111.477 -175.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.665 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 2.48 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.572 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 1.03 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 1.06 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.92 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.718 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.98 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.78 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.72 ' CG ' HG21 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 1.05 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 1.03 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.463 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 2.41 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.561 ' HB ' ' CG ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.9 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.773 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 1.06 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.784 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 1.03 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.773 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.9 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 1.03 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 1.02 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.6 ' C ' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 2.23 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.673 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 1.02 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.72 HG21 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.99 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.99 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.63 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 1.02 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.572 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.58 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 112.908 0.707 . . . . 1.01 112.908 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.58 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.13 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 0.2 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.691 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 0.53 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.688 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.15 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 0.1 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.75 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.654 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.11 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.61 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 0.17 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.36 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.506 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 91.7 m-20 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.15 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 0.66 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 0.21 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.856 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 0.1 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 0.09 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.562 ' HG2' HG22 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 1.95 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.682 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.32 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 72.6 mm-40 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.82 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.13 112.003 -175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.66 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 1.47 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.666 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 0.09 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.25 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.698 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.58 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 0.1 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 0.82 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.698 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.14 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.766 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 0.16 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.831 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 0.11 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.719 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 1.92 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 0.14 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.863 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.27 109.136 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.05 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.863 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 64.2 t60 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.17 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 0.22 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.786 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 0.21 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.453 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 0.11 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.35 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.18 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.02 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.439 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 0.25 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.72 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.604 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.1 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.75 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 0.04 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.07 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 HG22 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 0.07 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.723 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.1 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 0.06 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 0.95 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 0.05 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 0.05 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.3 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 0.05 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 0.12 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 2.94 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.14 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.884 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.06 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 0.1 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.682 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 0.14 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.61 ' C ' HG21 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.856 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 0.15 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.884 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 0.11 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.832 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 0.2 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 0.9 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.65 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 0.2 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 1.99 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.415 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 0.13 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 0.26 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.29 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.15 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.514 ' NZ ' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.22 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.649 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 0.2 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.468 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 0.18 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.468 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 1.87 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.16 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 0.26 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.794 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 0.09 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.29 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 0.09 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 0.07 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.539 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.605 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 1.66 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 0.06 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 128' ' ' LEU . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.09 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.33 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 0.1 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.624 HG22 HD11 ' A' ' 62' ' ' LEU . 77.6 t . . . . . 0 N--CA 1.442 -0.844 0 N-CA-C 112.871 0.693 . . . . 1.01 112.871 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.554 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.13 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 0.2 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 0.53 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.59 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.15 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 0.1 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.638 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.11 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.627 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 0.17 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.36 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.15 108.822 169.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 0.66 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 0.21 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.987 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 0.1 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.745 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 0.09 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.519 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 1.95 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.32 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.2 mm-40 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.82 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.13 111.125 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.612 ' HB3' HD21 ' A' ' 31' ' ' LEU . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 1.47 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 0.09 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.25 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.672 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.554 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 0.1 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 0.82 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.672 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.14 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.755 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 0.16 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.779 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 0.11 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 1.92 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 0.14 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.856 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.27 109.501 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.05 111.899 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.856 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 70.2 t60 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.17 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 0.22 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 0.21 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 0.11 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.35 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 77' ' ' SER . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.18 109.771 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.02 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.52 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 0.25 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.716 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.576 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.1 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 0.04 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.07 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.459 HG22 HG22 ' A' ' 119' ' ' THR . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 0.07 110.645 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 15.4 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.745 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 0.06 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.705 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 0.95 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 0.05 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.799 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 0.05 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.589 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.2 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.556 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 0.05 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 0.12 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.681 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.744 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.713 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 2.94 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.68 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.14 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.92 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.06 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.799 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 0.1 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 0.14 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.627 ' C ' HG21 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.987 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 0.15 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.92 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 0.11 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.813 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 0.2 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 0.9 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.58 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 0.2 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.713 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 1.99 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 0.13 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.604 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 0.26 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.29 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.15 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.22 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.723 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 0.2 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 0.18 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.815 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 1.87 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.16 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.822 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 0.26 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.75 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 0.09 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.815 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.822 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.29 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 0.09 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 0.07 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.66 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 1.66 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.744 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 0.06 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.723 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.09 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.33 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 0.1 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.581 HG22 HD11 ' A' ' 62' ' ' LEU . 55.4 t . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.624 0.601 . . . . 1.01 112.624 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 55' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.13 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.421 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 0.2 111.178 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.667 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 0.53 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.811 ' HE2' ' HZ3' ' A' ' 41' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.15 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 0.1 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.649 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.11 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.659 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 0.17 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.36 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.811 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 0.66 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.419 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 0.21 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.019 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.1 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.755 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 0.09 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 1.95 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.882 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.32 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.6 mm-40 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.82 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.13 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.635 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 1.47 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 0.09 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.25 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 0.1 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.572 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 0.82 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.14 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 0.16 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.767 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 0.11 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 1.92 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 0.14 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.27 109.587 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.516 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.05 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.516 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.767 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.1 t60 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.17 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 0.22 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.812 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 0.21 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.443 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 0.11 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.723 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.35 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.18 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.02 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.409 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 0.25 110.933 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.723 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.1 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 0.04 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.07 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 0.07 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.674 ' HB3' HD11 ' A' ' 44' ' ' LEU . 18.6 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.755 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 0.06 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 0.95 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 0.05 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 0.05 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.618 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 0.05 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 0.12 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.754 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 2.94 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.14 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.06 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 0.1 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.882 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 0.14 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.659 ' C ' HG21 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.019 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 0.15 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 0.11 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.514 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 0.2 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 0.9 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.626 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 0.2 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 1.99 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.509 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 0.13 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.611 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 0.26 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.29 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.754 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.15 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.22 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 0.2 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.438 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 0.18 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 1.87 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.665 HG21 ' HA ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.16 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.518 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.826 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 0.26 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.789 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 0.09 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.583 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.29 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 0.09 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.789 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 0.07 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.608 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 1.66 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 0.06 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.09 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.33 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 0.1 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.509 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.556 HG21 ' HG3' ' A' ' 67' ' ' GLU . 92.9 t . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 112.407 0.521 . . . . 1.01 112.407 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.617 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.13 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 0.2 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 0.53 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.15 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 0.1 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.617 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.11 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.641 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 0.17 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.36 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.15 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.481 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 0.66 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.447 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 0.21 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.043 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 0.1 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.762 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 0.09 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 1.95 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.7 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.32 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.2 mm-40 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.82 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.13 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.594 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 1.47 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.668 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 0.09 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.25 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 32' ' ' TYR . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 0.1 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 0.82 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.14 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 0.16 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.726 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 0.11 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.667 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 1.92 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.781 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 0.14 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.27 109.061 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.05 111.438 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.556 ' HG3' HG21 ' A' ' 25' ' ' VAL . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.726 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.0 t60 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.17 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 0.22 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.764 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 0.21 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 0.11 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.35 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.18 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.764 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.02 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 0.25 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.586 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.1 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.703 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.07 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.472 HG22 HG22 ' A' ' 119' ' ' THR . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 0.07 110.504 178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.774 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.2 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.762 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 0.06 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 0.95 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 0.05 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.804 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 0.05 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.4 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.539 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 0.05 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.698 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 0.12 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.722 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.699 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.716 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 2.94 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.698 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.14 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.06 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.804 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 0.1 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.7 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.641 ' C ' HG21 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.043 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 0.15 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 0.11 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 0.2 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASN . . . . . 0.444 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 0.9 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.632 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 0.2 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.716 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 1.99 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.498 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 0.13 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 0.26 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.29 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.722 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.15 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.22 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 0.2 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.45 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 0.18 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 1.87 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.774 HG21 ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.16 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 0.26 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 0.09 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.555 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.29 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 0.09 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 0.07 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.635 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 1.66 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 0.06 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.33 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 0.1 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.498 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.506 HG22 HD11 ' A' ' 62' ' ' LEU . 55.3 t . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 112.977 0.732 . . . . 1.01 112.977 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.664 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.13 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 0.2 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 0.53 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.586 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.15 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 0.1 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.725 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.604 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.11 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.668 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 0.17 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.36 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.468 ' O ' HG23 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.15 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 0.66 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 0.21 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 0.1 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.712 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 0.09 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 35' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 1.95 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.32 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.675 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.82 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.416 ' HD2' ' N ' ' A' ' 49' ' ' PHE . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.13 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.581 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 1.47 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 0.09 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.25 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.718 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 0.1 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.498 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 0.82 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.718 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.14 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.785 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 0.16 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.825 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 0.11 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.815 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 1.92 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 0.14 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.815 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.27 109.037 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.05 112.095 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.825 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.0 t60 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.17 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 0.22 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.771 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 0.21 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.474 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 0.11 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.35 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.18 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.771 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.02 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 0.25 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.1 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.725 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 0.04 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.714 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.07 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.434 HG22 HG22 ' A' ' 119' ' ' THR . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 0.07 110.586 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.733 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.8 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.712 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 0.06 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.714 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 0.95 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.617 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 0.05 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.835 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 0.05 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.9 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.617 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 0.05 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 0.12 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.717 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.679 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 2.94 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.14 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.924 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.06 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.835 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 0.1 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 0.14 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.668 ' C ' HG21 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.025 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 0.15 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.924 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 0.11 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.516 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 0.2 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 0.9 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 0.2 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.679 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 1.99 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.52 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 0.13 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 0.26 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.29 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.15 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.22 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 0.2 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 0.18 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 1.87 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.733 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.16 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.837 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 0.26 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.761 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 0.09 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.837 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.29 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 0.09 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 0.07 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.647 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 1.66 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.717 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 0.06 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.674 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.09 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.33 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 0.1 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.52 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.52 HG22 HD11 ' A' ' 62' ' ' LEU . 50.7 t . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 113.041 0.756 . . . . 1.01 113.041 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.648 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.13 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.64 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 0.2 110.91 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 0.53 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.604 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.15 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 0.1 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.11 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 0.17 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.563 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.36 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.563 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.15 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 0.66 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.498 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 0.21 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.085 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 0.1 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 0.09 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 1.95 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.844 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.32 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.544 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.6 mm-40 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.82 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.13 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.65 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 1.47 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 0.09 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.25 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.689 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 0.1 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 0.82 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.14 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.767 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 0.11 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 1.92 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 0.14 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.27 109.288 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.05 111.806 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.507 ' HG3' HG21 ' A' ' 25' ' ' VAL . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.806 ' CE1' HD13 ' A' ' 59' ' ' LEU . 64.4 t60 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.17 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 0.22 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 0.21 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 0.11 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.35 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.18 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.02 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 0.25 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.607 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.1 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 0.04 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.07 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 119' ' ' THR . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 0.07 110.619 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.728 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 0.06 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 0.95 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 0.05 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.738 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 0.05 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.628 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.8 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 0.05 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 0.12 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.684 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 2.94 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.14 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.855 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.06 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.738 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 0.1 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 0.14 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.085 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 0.15 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.855 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 0.11 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.497 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 0.2 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 0.9 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.674 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 0.2 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.684 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 1.99 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 0.26 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.29 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.15 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.22 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.467 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 0.18 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 1.87 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.728 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.16 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.803 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 0.26 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.801 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.732 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 0.09 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.589 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.803 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.29 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 0.09 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 0.07 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.666 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 1.66 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 0.06 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.705 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.09 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.33 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 0.1 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.529 HG22 HD11 ' A' ' 62' ' ' LEU . 66.9 t . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 113.154 0.798 . . . . 1.01 113.154 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.572 ' CE1' HD13 ' A' ' 55' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.576 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 0.2 111.015 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 0.53 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.725 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.15 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 0.1 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.611 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.11 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.637 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 0.17 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.585 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.36 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.585 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.15 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 0.66 110.532 174.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 0.21 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.008 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 0.1 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.772 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 0.09 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.421 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 1.95 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.32 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.1 mm-40 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.82 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.4 ' N ' ' CD2' ' A' ' 49' ' ' PHE . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.13 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.58 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 1.47 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 0.09 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.25 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.677 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.572 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 0.1 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 0.82 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.14 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 0.16 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.751 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 0.11 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 1.92 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 0.14 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.27 109.125 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.05 112.191 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.498 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.751 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.7 t60 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.17 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 0.22 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.809 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 0.21 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 0.11 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.721 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.35 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.18 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.02 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 0.25 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.721 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.1 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.746 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 0.04 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.07 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 0.07 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.787 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.772 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 0.06 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.692 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 0.95 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 0.05 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.764 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 0.05 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.617 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.8 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.579 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 0.05 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.716 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 0.12 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 2.94 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.716 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.14 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.88 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.06 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.764 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 0.14 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.637 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.008 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 0.15 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.88 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.503 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.773 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 0.2 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 0.9 109.272 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 0.2 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' HG3' ' A' ' 93' ' ' GLU . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 1.99 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 0.13 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.633 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 0.26 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.29 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.15 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.22 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.7 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 0.2 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 0.18 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 1.87 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.16 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.561 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.814 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 0.26 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.752 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 0.09 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.568 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.814 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.29 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 0.09 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 0.07 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.634 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 1.66 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.706 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 0.06 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.7 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.09 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.33 110.264 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 0.1 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.524 HG22 HD11 ' A' ' 62' ' ' LEU . 54.8 t . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 113.003 0.742 . . . . 1.01 113.003 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.573 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.13 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 0.2 111.019 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 0.53 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.15 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 0.1 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.11 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.716 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 0.17 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.36 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.15 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 0.66 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.551 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 0.21 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.077 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 0.1 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.725 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 0.09 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 1.95 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.911 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.32 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 23.3 mm-40 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.82 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.13 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 1.47 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 0.09 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.25 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.701 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.573 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 0.1 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 0.82 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.701 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.14 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 0.16 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.828 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 0.11 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.747 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 1.92 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 0.14 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.867 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.27 109.447 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.05 112.017 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.457 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.867 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 65.1 t60 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.17 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 0.22 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 0.21 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.449 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 0.11 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.644 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.35 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.18 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.02 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.515 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 0.25 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.1 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 0.04 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.07 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 119' ' ' THR . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 0.07 110.458 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.8 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.725 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 0.06 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.665 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 0.95 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 0.05 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 0.05 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.623 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.5 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 0.05 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 0.12 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.717 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.713 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.707 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 2.94 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.14 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.06 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 0.1 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.911 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 0.14 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.716 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.077 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 0.15 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 0.11 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.501 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.835 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 0.2 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 0.9 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.624 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 0.2 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.707 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 1.99 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.567 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 0.13 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.661 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.29 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.717 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.15 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.22 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 0.2 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 0.18 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 1.87 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.778 HG21 ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.16 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 0.26 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.769 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 0.09 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.29 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 0.09 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.769 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 0.07 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 1.66 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.713 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 0.06 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.09 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.33 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.835 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 0.1 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.567 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.6 m . . . . . 0 N--CA 1.439 -1.012 0 N-CA-C 113.476 0.917 . . . . 1.01 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.13 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.642 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 0.53 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.63 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.15 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 0.1 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.585 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.11 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.626 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 0.17 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.36 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.574 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.15 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.63 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 0.66 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.462 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 0.21 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.983 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 0.1 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.754 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 0.09 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HG2' HG22 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 1.95 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.32 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 80.1 mm-40 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.82 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.428 ' N ' ' HD2' ' A' ' 49' ' ' PHE . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.13 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 1.47 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 0.09 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.25 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.664 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.639 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 0.1 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.605 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 0.82 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.14 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.771 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 0.16 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.745 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 0.11 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.69 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.686 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 1.92 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 0.14 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.69 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.27 109.55 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.05 111.864 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' OE1' HD12 ' A' ' 70' ' ' LEU . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.745 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.1 t60 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.17 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 0.22 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.834 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 0.21 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.445 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 0.11 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.35 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.18 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.834 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.02 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.438 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 0.25 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.1 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 0.04 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.07 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.494 HG22 HG22 ' A' ' 119' ' ' THR . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 0.07 110.743 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.766 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.0 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.754 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 0.06 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 0.95 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 0.05 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.784 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 0.05 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.632 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.623 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 0.05 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.696 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 0.12 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.72 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.703 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.706 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 2.94 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.696 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.14 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.888 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.06 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.784 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 0.1 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 0.14 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.626 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.983 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 0.15 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.888 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 0.11 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.507 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 0.2 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 0.9 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.64 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 0.2 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.706 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 1.99 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 0.13 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 0.26 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.29 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.72 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.15 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.22 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.485 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 0.18 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 1.87 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.16 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.859 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 0.26 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.797 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.748 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 0.09 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HA ' HD12 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.859 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.29 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 0.09 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 0.07 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.651 ' HB3' HD22 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 1.66 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.703 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 0.06 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.09 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.33 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 0.1 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 112.928 0.714 . . . . 1.01 112.928 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.619 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.629 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 0.2 111.156 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 0.53 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.15 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 0.1 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.627 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.11 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 0.17 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.36 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.15 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 0.66 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.486 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 0.21 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.009 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 0.1 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 0.09 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 1.95 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.32 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.561 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.3 mm-40 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.82 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.469 ' N ' ' HD2' ' A' ' 49' ' ' PHE . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.13 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.62 ' CD ' HD11 ' A' ' 31' ' ' LEU . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 1.47 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.627 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 0.09 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.25 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.619 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 0.1 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 0.82 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.7 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.14 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 0.16 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.762 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 0.11 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.772 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 1.92 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.784 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 0.14 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.772 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.27 109.704 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.05 110.246 177.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.762 ' CE1' HD13 ' A' ' 59' ' ' LEU . 64.1 t60 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.17 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 0.22 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.819 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 0.21 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 0.11 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.35 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.18 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.819 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.02 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.414 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 0.25 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.1 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.756 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 0.04 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.07 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.437 HG22 HG22 ' A' ' 119' ' ' THR . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 0.07 110.555 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.705 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.4 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 0.06 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 0.95 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 0.05 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.801 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 0.05 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.6 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 0.05 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.721 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 0.12 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.733 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.717 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 2.94 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.721 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.14 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.875 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.06 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.801 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 0.1 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 0.14 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.009 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 0.15 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.875 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 0.11 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.532 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 0.2 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 0.9 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.625 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 0.2 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.717 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 1.99 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 0.13 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 0.26 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.29 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.733 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.15 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.22 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 0.2 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.48 HG21 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 0.18 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 1.87 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.705 HG21 ' HA ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.16 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 0.26 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.766 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 0.09 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.29 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 0.09 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 0.07 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.665 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 1.66 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 0.06 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.688 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.09 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.33 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 0.1 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.557 HG22 HD11 ' A' ' 62' ' ' LEU . 59.1 t . . . . . 0 N--CA 1.439 -1.01 0 N-CA-C 112.776 0.658 . . . . 1.01 112.776 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.671 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.13 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 0.2 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 0.53 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.15 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 0.1 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.662 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.11 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.708 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 0.17 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.57 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.36 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.57 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.15 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.58 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 0.66 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 0.21 109.466 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.033 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 0.1 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.734 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 0.09 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 1.95 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.885 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.32 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 61.2 mm-40 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.82 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.13 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.637 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 1.47 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.664 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 0.09 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.25 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.69 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.537 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 0.1 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 0.82 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.69 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.14 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 0.16 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.807 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 0.11 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.714 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 1.92 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 0.14 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.891 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.27 109.863 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.05 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.891 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 70.4 t60 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.17 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 0.22 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.794 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 0.21 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.464 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 0.11 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.662 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.35 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 77' ' ' SER . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.18 109.61 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.02 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 0.25 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.1 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 0.04 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.07 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.468 HG22 HG22 ' A' ' 119' ' ' THR . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 0.07 110.523 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.734 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 0.06 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 0.95 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 0.05 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.742 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 0.05 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 0.05 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 86' ' ' GLN . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 0.12 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.712 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.705 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.71 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 2.94 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.14 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.867 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.06 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.742 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 0.1 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.885 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 0.14 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.708 ' C ' HG21 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.033 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 0.15 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.867 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 0.11 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.52 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.765 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 0.2 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 0.9 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.662 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 0.2 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.71 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 1.99 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 0.13 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.629 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 0.26 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.29 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.712 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.15 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.22 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 0.2 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.496 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 0.18 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 1.87 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.704 HG21 ' HA ' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.16 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.535 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.832 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 0.26 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.804 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.794 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 0.09 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.832 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.29 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 0.09 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 0.07 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.686 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 1.66 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 0.06 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.09 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.33 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.765 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 0.1 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.693 HG21 ' HG3' ' A' ' 67' ' ' GLU . 55.5 t . . . . . 0 N--CA 1.422 -1.827 0 CA-C-O 121.217 0.532 . . . . 1.01 110.86 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.13 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.677 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 0.2 110.911 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.687 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 0.53 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.693 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.15 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 0.1 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.659 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.11 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.67 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 0.17 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.36 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.15 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.46 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 0.66 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 0.21 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.046 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 0.1 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 0.09 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 1.95 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.32 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 81.8 mm-40 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.82 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.414 ' HD2' ' N ' ' A' ' 49' ' ' PHE . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.13 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.642 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 1.47 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 0.09 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.25 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 0.1 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 0.82 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.14 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.721 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 0.16 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.825 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 0.11 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.704 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 1.92 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.721 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 0.14 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.881 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.27 109.432 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.05 110.636 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.693 ' HG3' HG21 ' A' ' 25' ' ' VAL . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.881 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 71.1 t60 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.17 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 0.22 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 0.21 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 0.11 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.35 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.18 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.02 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 0.25 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.1 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 0.04 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.724 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.07 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 0.07 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.745 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.5 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.742 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 0.06 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 0.95 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 0.05 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.793 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 0.05 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.561 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.605 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 0.05 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 0.12 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.696 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 2.94 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.693 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.14 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.06 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.793 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 0.1 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 0.14 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.67 ' C ' HG21 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.046 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 0.15 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 0.11 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.489 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 0.2 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 0.9 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.673 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 0.2 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.705 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 1.99 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 0.13 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.653 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 0.26 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.29 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.696 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.15 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.22 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 0.2 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 0.18 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 1.87 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.745 HG21 ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.16 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 0.26 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 0.09 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.29 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 0.09 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 0.07 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.588 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 1.66 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 0.06 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.33 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 0.1 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.564 HG22 HD11 ' A' ' 62' ' ' LEU . 53.7 t . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 113.251 0.834 . . . . 1.01 113.251 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.543 ' CE1' HD13 ' A' ' 55' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.13 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.592 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 0.2 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 0.53 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.15 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 0.1 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.11 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 0.17 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.36 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.54 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.15 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.64 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 0.66 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.592 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 0.21 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.035 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 0.1 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 0.09 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 1.95 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.32 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.82 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.443 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.13 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 1.47 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.672 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 0.09 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.25 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.693 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.574 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 0.1 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 0.82 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.14 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.76 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 0.16 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.738 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 0.11 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 1.92 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 0.14 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.681 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.27 109.056 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.601 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.05 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 66' ' ' ARG . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.738 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.8 t60 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.17 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 0.22 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 0.21 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.465 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 0.11 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.35 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.18 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.02 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.432 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 0.25 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.729 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.1 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 0.04 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.07 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 0.07 110.544 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.783 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 0.06 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 0.95 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.615 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 0.05 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.748 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 0.05 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.602 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.518 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.615 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 0.05 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 0.12 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.713 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.685 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 2.94 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.14 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.842 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.06 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.748 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 0.1 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 0.14 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.035 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 0.15 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.842 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 0.11 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.819 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 0.2 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 0.9 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.636 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 0.2 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.711 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 1.99 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 0.13 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 0.26 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.29 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.713 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.15 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.22 108.094 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.698 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 0.2 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.5 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 0.18 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 1.87 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.16 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.592 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 0.26 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 0.09 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.579 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.29 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 0.09 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 0.07 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.636 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 1.66 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 0.06 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.09 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.33 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.819 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 0.1 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.608 HG22 HD11 ' A' ' 62' ' ' LEU . 70.3 t . . . . . 0 N--CA 1.44 -0.959 0 N-CA-C 112.65 0.611 . . . . 1.01 112.65 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.627 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.13 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.675 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 0.2 111.015 -176.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.967 ' HG ' HE22 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 0.53 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.15 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 0.1 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.726 ' CE2' HD12 ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.11 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.691 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 0.17 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.587 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.36 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.587 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.15 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 0.66 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.789 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 0.21 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.105 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 0.1 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.785 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 0.09 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 1.95 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.32 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 52.7 mm-40 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.82 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.411 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.13 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 1.47 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.683 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 0.09 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.25 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.967 HE22 ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 0.1 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.658 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 0.82 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.671 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.14 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.779 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 0.16 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.736 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 0.11 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.711 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.597 ' HE2' HD23 ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 1.92 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.779 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 0.14 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.27 109.312 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.05 110.784 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.548 ' HG2' HG21 ' A' ' 25' ' ' VAL . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.736 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.3 t60 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.17 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 0.22 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.791 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 0.21 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.435 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 0.11 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.35 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.18 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.791 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.02 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.425 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 0.25 110.584 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.1 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.695 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 0.04 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.682 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.07 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 0.07 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.755 ' HA ' HG21 ' A' ' 119' ' ' THR . 21.6 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.785 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 0.06 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.682 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 0.95 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.629 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 0.05 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.781 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 0.05 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.633 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.4 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 0.05 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 0.12 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.725 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.692 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 2.94 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.14 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.861 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.06 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.781 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 0.1 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.412 -175.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.691 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.105 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 0.15 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.861 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 0.11 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.827 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 0.2 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 0.9 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 0.2 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.692 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 1.99 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.459 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 0.13 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 0.26 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.29 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.15 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.22 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 0.2 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.509 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 0.18 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 1.87 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.16 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.838 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 0.26 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.789 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 0.09 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.574 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.838 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.29 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 0.09 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 0.07 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.655 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 1.66 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.725 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 0.06 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.09 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.33 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 0.1 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.516 HG22 HD11 ' A' ' 62' ' ' LEU . 53.8 t . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 113.145 0.795 . . . . 1.01 113.145 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.675 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.13 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.549 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 0.2 110.801 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.673 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 0.53 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.15 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 0.1 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.653 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.11 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 0.17 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.36 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.613 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.15 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 0.66 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.515 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 0.21 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 0.1 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.764 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 0.09 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.539 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 1.95 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.32 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.547 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 34.0 mm-40 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.82 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.43 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.13 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 1.47 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 0.09 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.25 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.686 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 0.1 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.598 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 0.82 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.14 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.16 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.767 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 0.11 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.693 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 1.92 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.727 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 0.14 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.27 110.113 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.05 110.268 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.459 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.767 ' CE1' HD13 ' A' ' 59' ' ' LEU . 66.4 t60 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.17 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 0.22 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 0.21 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.441 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 0.11 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.35 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.18 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.02 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 0.25 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.584 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.1 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 0.04 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.07 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.453 HG22 HG22 ' A' ' 119' ' ' THR . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 0.07 110.622 179.173 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.78 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.764 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 0.06 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 0.95 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 0.05 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 0.05 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.64 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.604 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 0.05 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.7 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 0.12 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.686 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 2.94 107.334 173.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.14 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.849 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.06 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 0.1 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 0.14 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 0.15 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.849 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 0.11 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.806 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 0.2 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 0.9 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.642 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 0.2 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 1.99 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 0.13 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.636 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.29 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.686 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.15 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.22 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.703 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 0.2 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 0.18 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 1.87 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.16 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.794 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 0.26 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 0.09 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.29 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.8 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 0.09 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 0.07 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.65 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 1.66 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.691 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 0.06 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.703 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.09 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.33 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 0.1 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.7 m . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 113.54 0.941 . . . . 1.01 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.649 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.13 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.591 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 0.2 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.686 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 0.53 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.708 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.15 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 0.1 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.603 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.11 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.689 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 0.17 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.36 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.15 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.484 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 0.66 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.483 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 0.21 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.013 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 0.1 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 0.09 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 1.95 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.32 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 84.1 mm-40 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.82 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.406 ' N ' ' CD2' ' A' ' 49' ' ' PHE . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.13 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.591 ' HD2' HD11 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 1.47 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 0.09 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.25 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.528 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 0.1 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.617 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 0.82 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.14 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 0.16 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.733 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 0.11 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.672 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 1.92 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 0.14 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.27 109.582 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.05 112.348 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.733 ' CE1' HD13 ' A' ' 59' ' ' LEU . 68.1 t60 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.17 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 0.22 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 0.21 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.442 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 0.11 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.35 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.18 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.02 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 0.25 110.776 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.1 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 0.04 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.688 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.07 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 119' ' ' THR . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 0.07 110.6 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.693 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.1 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 0.06 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 0.95 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.622 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 0.05 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 0.05 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.624 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 0.05 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 0.12 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.718 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.695 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 2.94 109.17 169.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.14 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.06 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 0.1 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 0.14 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.689 ' C ' HG21 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.013 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 0.15 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 0.11 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.51 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.811 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 0.2 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 0.9 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.583 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 0.2 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.695 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 1.99 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.531 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 0.13 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.632 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 0.26 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.29 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.15 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.22 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.681 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 0.2 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.435 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 0.18 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.443 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 1.87 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.16 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 0.26 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.815 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 0.09 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.29 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 0.09 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 0.07 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.6 ' HB3' HD22 ' A' ' 102' ' ' LEU . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 1.66 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 0.06 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.681 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.09 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.33 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 0.1 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.531 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.505 HG22 HD11 ' A' ' 62' ' ' LEU . 42.6 t . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 112.491 0.552 . . . . 1.01 112.491 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.13 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 0.2 111.186 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 0.53 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.15 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 0.1 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.731 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.635 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.11 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.69 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 0.17 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.36 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.15 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 0.66 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.62 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 0.21 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.076 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 0.1 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 0.09 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.56 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 1.95 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.654 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.32 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.487 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 63.9 mm-40 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.82 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 46' ' ' ASN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.13 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.604 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 1.47 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 0.09 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.25 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.678 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 0.1 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 0.82 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.696 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.14 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 0.16 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.754 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 0.11 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.696 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 1.92 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 0.14 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.27 109.905 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.05 110.154 176.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' OE1' HD12 ' A' ' 70' ' ' LEU . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.754 ' CE1' HD13 ' A' ' 59' ' ' LEU . 70.1 t60 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.17 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 0.22 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.74 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 0.21 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 0.11 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.35 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.18 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.74 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.02 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 0.25 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.1 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.731 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 0.04 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.07 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG22 ' A' ' 119' ' ' THR . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 0.07 110.808 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.72 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.0 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 0.06 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 0.95 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.616 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 0.05 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 0.05 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.646 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.2 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.545 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 0.05 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 0.12 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.708 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 2.94 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.14 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.874 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.06 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.78 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 0.1 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.654 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 0.14 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.69 ' C ' HG21 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.076 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 0.15 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.874 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.489 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.86 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 0.2 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 0.9 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 0.2 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.678 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 1.99 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 0.13 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 0.26 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.29 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.15 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.22 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 0.2 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.473 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 0.18 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.402 ' HA ' ' CG ' ' A' ' 125' ' ' ASP . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 1.87 109.869 169.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.72 HG21 ' HA ' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.16 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.62 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.862 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 0.26 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.791 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 0.09 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.862 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.29 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 0.09 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 0.07 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.623 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 1.66 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.708 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 0.06 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.695 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.09 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.33 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.86 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 0.1 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.525 HG22 HD11 ' A' ' 62' ' ' LEU . 55.8 t . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 112.994 0.739 . . . . 1.01 112.994 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.13 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.419 ' ND2' HG13 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.166 -174.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.671 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 0.53 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.767 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.15 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 0.1 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.586 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.11 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 0.17 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.36 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.15 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.709 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 0.66 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.754 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 0.21 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.137 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 0.1 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.751 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 0.09 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.523 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 1.95 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.32 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.522 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.1 mm-40 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.82 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.13 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.625 ' HB3' HD21 ' A' ' 31' ' ' LEU . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 1.47 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.662 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 0.09 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.25 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 0.1 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.625 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 0.82 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.14 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.747 ' O ' HD22 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 0.16 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.729 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 0.11 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.71 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 1.92 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 0.14 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.27 109.796 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.05 111.443 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' HG3' HG21 ' A' ' 25' ' ' VAL . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.729 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.0 t60 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.17 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 0.22 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 0.21 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.555 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 0.11 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.35 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.18 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.02 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.544 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 0.25 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.1 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 0.04 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.07 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.446 HG22 HG22 ' A' ' 119' ' ' THR . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 0.07 110.586 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 19.5 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.751 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 0.06 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 0.95 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 0.05 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.817 HG23 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 0.05 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.58 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.1 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.05 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 0.12 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.719 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.686 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 2.94 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.14 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.893 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.06 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.817 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 0.1 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 0.14 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.137 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 0.15 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.893 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 0.11 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.506 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.831 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 0.2 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 0.9 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.651 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 0.2 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.686 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 1.99 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.517 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 0.13 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 0.26 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.29 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.719 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.15 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.22 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 0.2 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.47 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 0.18 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HA ' ' OD1' ' A' ' 125' ' ' ASP . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 1.87 109.609 169.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.16 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.88 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 0.26 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.754 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.742 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 0.09 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.88 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.29 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 0.09 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 0.07 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 1.66 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.716 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 0.06 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.09 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.33 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.831 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 0.1 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.9 m . . . . . 0 N--CA 1.439 -1.009 0 N-CA-C 113.133 0.79 . . . . 1.01 113.133 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.643 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.13 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.593 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 0.2 111.051 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.674 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 0.53 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.593 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.15 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 0.1 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.613 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.11 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 0.17 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.36 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.15 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.475 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 0.66 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.454 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 0.21 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.074 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 0.1 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.749 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 0.09 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 1.95 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.68 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.32 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 63.9 mm-40 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.82 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.519 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.13 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.647 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 1.47 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 0.09 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.25 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.666 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 0.1 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 0.82 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.67 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.14 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.756 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 0.16 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.798 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 0.11 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 1.92 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.756 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 0.14 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.65 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.27 109.192 -177.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.05 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.544 ' OE1' HD12 ' A' ' 70' ' ' LEU . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.798 ' CE1' HD13 ' A' ' 59' ' ' LEU . 63.5 t60 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.17 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 0.22 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 0.21 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.454 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 0.11 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.35 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 77' ' ' SER . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.18 109.843 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.02 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 0.25 110.826 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.1 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.737 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 0.04 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.07 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.484 HG22 HG22 ' A' ' 119' ' ' THR . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 0.07 110.634 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.758 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.7 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.749 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 0.95 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 0.05 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 0.05 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.553 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 0.05 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.684 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 0.12 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.731 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.704 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 2.94 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.684 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.14 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.903 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.06 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 0.1 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.68 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 0.14 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.074 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 0.15 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.903 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 0.11 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.496 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.837 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 0.2 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 0.9 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 0.2 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.704 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 1.99 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 0.13 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.591 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 0.26 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.29 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.731 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.15 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.22 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.693 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 0.2 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.506 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 0.18 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 1.87 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.16 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 0.26 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.765 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 0.09 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.29 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 0.09 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 0.07 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 1.66 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 0.06 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.09 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.33 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.837 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 0.1 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.7 HG22 HD11 ' A' ' 62' ' ' LEU . 54.1 t . . . . . 0 N--CA 1.427 -1.594 0 CA-C-O 121.507 0.67 . . . . 1.01 111.134 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.13 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 0.2 110.953 -175.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.701 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 0.53 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.745 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.15 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 0.1 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.759 ' CG ' HD11 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.11 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 0.17 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.36 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.522 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.15 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.745 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.66 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 0.21 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.079 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 0.1 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.716 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 0.09 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 1.95 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.32 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.4 mm-40 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.82 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.13 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.633 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 1.47 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.632 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 0.09 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.25 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.711 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 0.1 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 0.82 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.711 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.14 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.645 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 0.16 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.76 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 0.11 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.808 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 57' ' ' THR . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 1.92 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.7 HD11 HG22 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 0.14 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.808 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.27 109.294 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.05 110.526 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.685 ' HG3' HG21 ' A' ' 25' ' ' VAL . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.76 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.8 t60 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.17 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 0.22 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.805 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 0.21 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.432 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 0.11 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.35 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.18 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.02 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.424 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 0.25 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.595 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.1 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.759 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.69 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.07 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 0.07 110.654 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.718 ' HA ' HG21 ' A' ' 119' ' ' THR . 21.7 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.716 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.69 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 0.95 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 0.05 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 0.05 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.596 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 0.05 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 0.12 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.734 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 2.94 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.14 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.882 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.06 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 0.14 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 1.079 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 0.15 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.882 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 0.11 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.504 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' THR . . . . . 0.858 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 0.2 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 0.9 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 0.2 111.477 -175.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.691 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 1.99 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.587 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 0.13 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 0.26 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.29 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.15 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.22 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.714 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 0.2 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.497 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 0.18 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.477 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 1.87 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' HA ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.16 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 0.26 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 0.09 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.29 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 0.09 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 0.07 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 1.66 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 0.06 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.714 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.09 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.33 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.858 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLY . . . . . 0.587 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.936 -0.466 . . . . 22.48 111.936 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -100.48 -7.59 24.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.848 0.356 . . . . 23.33 110.687 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 58.8 ttp -76.59 -52.32 9.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 22.11 110.096 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 60.82 81.33 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.843 0.714 . . . . 20.59 111.697 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.9 m -105.15 151.6 7.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.926 -0.579 . . . . 18.37 109.907 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.06 -163.85 1.57 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.508 -0.314 . . . . 16.65 110.617 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -4.29 45.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.73 -0.214 . . . . 17.53 111.195 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -53.97 -55.53 26.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.234 -0.439 . . . . 15.09 111.159 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.4 m -116.51 52.79 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.634 0.731 . . . . 13.75 110.23 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -140.01 50.11 1.74 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.638 -0.875 . . . . 14.58 108.638 176.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 68.79 173.32 0.29 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 114.488 -1.233 . . . . 13.16 110.93 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.8 mt -88.6 83.49 2.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.93 -0.577 . . . . 10.1 109.852 178.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.44 -173.61 3.73 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.885 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 m 72.16 163.23 0.27 Allowed 'General case' 0 CA--C 1.536 0.421 0 O-C-N 123.784 0.677 . . . . 7.42 110.475 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m 69.24 16.68 8.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.609 0.719 . . . . 6.06 110.188 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -140.6 54.17 1.6 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.34 -0.985 . . . . 6.06 108.34 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m 64.75 -172.51 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.822 -1.081 . . . . 2.91 110.178 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -71.36 148.37 47.08 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.915 0.388 . . . . 1.44 111.187 178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 38.3 m -142.87 146.53 34.19 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.294 0.568 . . . . 1.25 110.821 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.753 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -77.52 -174.22 3.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 122.329 1.062 . . . . 0.39 112.104 -175.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.3 m-80 -129.83 158.2 40.11 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.323 -1.762 . . . . 0.43 107.041 -173.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -78.9 -15.53 58.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.816 0.735 . . . . 1.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 t -80.25 -10.27 59.75 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 107.782 -1.192 . . . . 1.36 107.782 171.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.672 ' HB3' HD13 ' A' ' 62' ' ' LEU . 86.9 m-20 -98.53 -44.43 6.48 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.199 -1.364 . . . . 1.27 109.617 175.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.58 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t -90.87 -54.47 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 114.031 -1.441 . . . . 1.01 112.908 -167.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.58 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.13 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 0.2 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.691 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 0.53 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.688 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.15 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 0.1 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.75 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.654 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.11 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.61 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 0.17 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.36 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.506 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 91.7 m-20 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.15 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 0.66 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 0.21 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.856 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 0.1 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 0.09 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.562 ' HG2' HG22 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 1.95 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.682 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.32 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 72.6 mm-40 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.82 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.13 112.003 -175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 1.47 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.666 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 0.09 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.25 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.698 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.58 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 0.1 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 0.82 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.698 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.14 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.766 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 0.16 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.831 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 0.11 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.719 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 1.92 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 0.14 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.863 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.493 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.27 109.136 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.503 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.05 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.753 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.863 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 64.2 t60 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.17 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 0.22 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.786 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 0.21 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.453 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 0.11 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.35 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.18 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.02 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.439 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 0.25 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.72 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.604 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.1 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.75 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 0.04 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.07 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 HG22 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 0.07 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.723 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.1 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 0.06 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 0.95 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 0.05 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 0.05 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.3 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 0.05 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 0.12 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 2.94 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.14 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.884 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.06 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 0.1 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.682 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 0.14 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.61 ' C ' HG21 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.856 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 0.15 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.884 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 0.11 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.832 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 0.2 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 0.9 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.65 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 0.2 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 1.99 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.415 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 0.13 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 0.26 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.29 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.15 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.514 ' NZ ' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.22 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.649 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 0.2 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.468 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 0.18 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.468 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 1.87 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.16 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 0.26 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.794 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 0.09 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.29 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 0.09 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 0.07 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.539 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.605 ' HE3' ' HA ' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 1.66 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 0.06 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 128' ' ' LEU . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.09 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.33 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 0.1 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.837 -0.505 . . . . 22.48 111.837 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -133.51 76.59 1.68 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.243 0.544 . . . . 23.33 110.415 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 42.9 ttm -88.59 -48.11 7.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.582 -0.735 . . . . 22.11 110.075 177.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -93.85 64.08 3.38 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.364 -0.835 . . . . 20.59 110.566 -175.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.5 -38.5 46.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.318 0.58 . . . . 18.37 109.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.9 113.55 24.32 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.622 -0.717 . . . . 16.65 110.057 176.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 8' ' ' SER . 3.7 ppt_? -68.43 -18.46 64.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 17.53 111.064 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.435 ' N ' ' HD2' ' A' ' 7' ' ' ARG . 52.4 p -165.01 -52.36 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 15.09 110.052 173.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 t -170.74 145.59 2.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.041 -0.527 . . . . 13.75 111.244 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -146.03 10.79 1.18 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.526 0.679 . . . . 14.58 109.324 172.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' A' ' 12' ' ' ILE . 30.8 tt0 -137.12 -173.92 3.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.479 -0.934 . . . . 13.16 108.479 -175.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.61 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 71.3 mt -68.49 86.33 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.311 0.577 . . . . 10.1 109.687 171.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -135.51 -14.2 1.96 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.64 -0.709 . . . . 10.66 110.436 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.4 t -128.22 23.98 5.97 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.542 -0.754 . . . . 7.42 110.166 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 12.8 p -67.04 123.09 19.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.459 -0.791 . . . . 6.06 109.869 177.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 15' ' ' SER . 42.9 tt0 70.68 -67.3 0.25 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.615 0.572 . . . . 6.06 110.442 -175.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.4 m -128.35 168.83 14.99 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 2.91 110.103 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 82.2 p -77.02 -160.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.988 -0.551 . . . . 1.44 110.907 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.593 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 33.1 m -117.15 140.91 48.94 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.358 -0.608 . . . . 1.25 109.358 167.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -71.41 172.97 8.5 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 122.541 1.162 . . . . 0.39 112.359 -172.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.484 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.8 m-80 -115.28 153.23 31.3 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 112.728 -2.033 . . . . 0.43 107.59 -173.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.6 mp0 -77.7 -10.5 59.56 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.076 -0.65 . . . . 1.0 110.914 -177.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 p -83.82 -9.93 58.42 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.515 -0.92 . . . . 1.36 108.515 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.618 ' HB3' HD13 ' A' ' 62' ' ' LEU . 82.5 m-20 -98.12 -46.99 5.66 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.36 -1.291 . . . . 1.27 109.066 174.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.624 HG22 HD11 ' A' ' 62' ' ' LEU . 77.6 t -85.29 -53.93 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 113.667 -1.606 . . . . 1.01 112.871 -165.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.554 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.13 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 0.2 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 0.53 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.59 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.15 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 0.1 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.638 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.11 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.627 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 0.17 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.36 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.15 108.822 169.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 0.66 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 0.21 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.987 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 0.1 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.745 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 0.09 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.519 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 1.95 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.32 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.2 mm-40 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.82 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.13 111.125 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.612 ' HB3' HD21 ' A' ' 31' ' ' LEU . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 1.47 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 0.09 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.25 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.672 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.554 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 0.1 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 0.82 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.672 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.14 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.755 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 0.16 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.779 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 0.11 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 1.92 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 0.14 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.856 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.27 109.501 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.602 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.05 111.899 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.742 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.856 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 70.2 t60 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.17 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 0.22 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 0.21 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 0.11 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.35 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 77' ' ' SER . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.18 109.771 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.02 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.52 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 0.25 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.716 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.576 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.1 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 0.04 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.07 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.459 HG22 HG22 ' A' ' 119' ' ' THR . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 0.07 110.645 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 15.4 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.745 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 0.06 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.705 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 0.95 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 0.05 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.799 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 0.05 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.589 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.2 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.556 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 0.05 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 0.12 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.681 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.744 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.713 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 2.94 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.68 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.14 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.92 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.06 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.799 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 0.1 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 0.14 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.627 ' C ' HG21 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.987 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 0.15 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.92 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 0.11 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.813 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 0.2 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 0.9 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.58 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 0.2 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.713 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 1.99 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 0.13 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.604 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 0.26 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.29 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.15 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.22 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.723 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 0.2 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 0.18 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.815 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 1.87 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.16 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.822 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 0.26 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.75 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 0.09 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.815 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.822 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.29 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 0.09 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 0.07 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.66 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 1.66 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.744 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 0.06 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.723 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.09 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.33 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 0.1 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.072 -0.411 . . . . 22.48 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -132.84 31.4 3.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.79 0.329 . . . . 23.33 110.685 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt 66.37 107.21 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.396 -0.82 . . . . 22.11 111.999 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -98.23 -85.54 0.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.071 -0.513 . . . . 20.59 110.161 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.0 m -137.97 158.39 33.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.976 -0.556 . . . . 18.37 109.657 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.95 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.744 0.652 . . . . 16.65 111.116 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -65.46 -20.01 66.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.156 -0.474 . . . . 17.53 111.447 -176.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m 60.98 -159.51 0.32 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.786 -0.643 . . . . 15.09 111.189 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.7 m -89.51 -60.17 2.02 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.906 -0.405 . . . . 13.75 109.906 175.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -164.68 -59.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.962 -0.755 . . . . 14.58 108.962 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -133.02 153.92 51.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 13.16 109.502 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.12 85.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.291 0.567 . . . . 10.1 110.378 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -131.42 -66.01 0.74 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.674 -0.694 . . . . 10.66 109.785 177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.625 HG23 HG23 ' A' ' 18' ' ' THR . 9.8 m -139.8 57.17 1.63 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.724 -1.126 . . . . 7.42 109.29 -176.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -76.84 -20.3 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.828 -0.624 . . . . 6.06 111.717 -174.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -130.5 39.38 3.63 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.653 0.739 . . . . 6.06 109.866 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m 58.96 -168.61 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.901 -1.045 . . . . 2.91 112.141 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.625 HG23 HG23 ' A' ' 14' ' ' THR . 25.7 p -141.29 159.85 41.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.348 -0.842 . . . . 1.44 110.331 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 30.1 m -145.98 143.18 29.32 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.452 0.644 . . . . 1.25 110.547 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -74.31 174.37 8.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.642 -1.163 . . . . 0.39 112.257 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 9.8 m-80 -112.42 150.72 30.75 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.79 -2.004 . . . . 0.43 107.46 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.7 mp0 -76.34 -9.75 58.88 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.76 -178.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 p -82.29 -14.4 55.45 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.483 -0.932 . . . . 1.36 108.483 170.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.621 ' HB3' HD13 ' A' ' 62' ' ' LEU . 80.1 m-20 -93.02 -47.06 7.18 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.324 -1.307 . . . . 1.27 108.765 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.581 HG22 HD11 ' A' ' 62' ' ' LEU . 55.4 t -82.58 -48.62 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.076 -1.875 . . . . 1.01 112.624 -166.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 55' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.13 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.421 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 0.2 111.178 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.667 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 0.53 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.811 ' HE2' ' HZ3' ' A' ' 41' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.15 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 0.1 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.649 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.11 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.659 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 0.17 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.36 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.811 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 0.66 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.419 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 0.21 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.019 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.1 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.755 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 0.09 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 1.95 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.882 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.32 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.6 mm-40 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.82 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.13 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.635 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 1.47 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 0.09 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.25 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 0.1 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 0.82 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.14 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 0.16 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.767 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 0.11 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 1.92 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 0.14 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.27 109.587 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.516 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.05 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.779 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.767 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.1 t60 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.17 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 0.22 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.812 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 0.21 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.443 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 0.11 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.723 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.35 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.18 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.02 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.409 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 0.25 110.933 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.723 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.1 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 0.04 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.07 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 0.07 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.674 ' HB3' HD11 ' A' ' 44' ' ' LEU . 18.6 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.755 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 0.06 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 0.95 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 0.05 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 0.05 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.618 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 0.05 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 0.12 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.754 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 2.94 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.14 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.06 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 0.1 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.882 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 0.14 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.659 ' C ' HG21 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.019 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 0.15 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 0.11 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.514 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 0.2 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 0.9 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.626 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 0.2 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 1.99 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.509 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 0.13 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.611 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 0.26 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.29 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.754 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.15 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.22 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 0.2 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.438 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 0.18 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 1.87 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.665 HG21 ' HA ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.16 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.518 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.826 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 0.26 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.789 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 0.09 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.583 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.29 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 0.09 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.789 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 0.07 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.608 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 1.66 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 0.06 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.09 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.33 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 0.1 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.509 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 112.019 -0.432 . . . . 22.48 112.019 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -103.85 -60.83 1.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.731 -0.276 . . . . 23.33 111.531 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -91.28 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.942 0.349 . . . . 22.11 111.942 -174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 56.27 88.07 0.05 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 122.911 0.484 . . . . 20.59 111.404 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -69.25 137.63 23.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.01 -0.541 . . . . 18.37 110.777 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.62 137.57 33.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 16.65 110.361 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.76 -32.16 72.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.443 -0.798 . . . . 17.53 110.86 -175.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 t 68.82 -71.37 0.12 Allowed 'General case' 0 CA--C 1.531 0.218 0 O-C-N 124.143 0.902 . . . . 15.09 110.777 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 29.2 m -83.49 103.25 12.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 120.997 0.427 . . . . 13.75 110.358 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -106.58 -56.97 2.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.177 -0.465 . . . . 14.58 109.754 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 65.75 137.35 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 O-C-N 124.074 0.859 . . . . 13.16 111.255 -178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.508 HD12 ' N ' ' A' ' 12' ' ' ILE . 2.6 mp -73.08 86.16 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.403 0.62 . . . . 10.1 109.879 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -127.59 -28.08 2.79 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.256 -0.884 . . . . 10.66 110.386 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.0 t -74.89 139.34 43.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.065 -0.516 . . . . 7.42 110.322 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 t 63.27 36.84 11.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.584 0.707 . . . . 6.06 109.795 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -91.72 -72.94 0.56 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.494 -0.775 . . . . 6.06 111.178 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m 55.77 72.9 0.46 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.705 -0.68 . . . . 2.91 110.354 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.464 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 78.7 p 61.13 146.71 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.341 1.057 . . . . 1.44 113.026 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.515 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 22.2 m -140.74 148.8 41.27 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.703 -0.68 . . . . 1.25 109.681 173.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.638 ' CB ' HD12 ' A' ' 62' ' ' LEU . . . -84.72 172.46 11.5 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.281 -0.872 . . . . 0.39 111.158 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.4 m-80 -108.04 171.05 7.62 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.971 -1.468 . . . . 0.43 108.08 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.534 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 9.5 mm100 -84.25 -18.38 36.66 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 119.863 1.211 . . . . 1.0 111.478 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m -78.01 -10.3 59.53 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.493 -1.299 . . . . 1.36 107.493 171.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HB3' HD13 ' A' ' 62' ' ' LEU . 40.5 m-20 -97.97 -46.82 5.77 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 113.782 -1.554 . . . . 1.27 108.877 175.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.556 HG21 ' HG3' ' A' ' 67' ' ' GLU . 92.9 t -96.31 -61.64 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 CA-C-N 113.693 -1.594 . . . . 1.01 112.407 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.523 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.617 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.13 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 0.2 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 0.53 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.15 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 0.1 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.617 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.11 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.641 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 0.17 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.36 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.15 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.481 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 0.66 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.447 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 0.21 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.043 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 0.1 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.762 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 0.09 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 1.95 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.7 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.32 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.2 mm-40 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.82 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.13 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.594 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 1.47 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.668 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 0.09 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.25 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 32' ' ' TYR . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 0.1 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 0.82 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.14 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 0.16 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.726 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 0.11 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.667 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 1.92 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.781 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 0.14 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.462 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.27 109.061 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.515 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.05 111.438 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.726 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.0 t60 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.17 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 0.22 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.764 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 0.21 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 0.11 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.35 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.18 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.764 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.02 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 0.25 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.586 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.1 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.703 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.07 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.472 HG22 HG22 ' A' ' 119' ' ' THR . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 0.07 110.504 178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.774 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.2 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.762 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 0.06 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 0.95 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 0.05 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.804 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 0.05 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.4 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.539 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 0.05 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.698 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 0.12 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.722 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.699 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.716 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 2.94 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.698 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.14 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.06 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.804 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 0.1 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.7 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.641 ' C ' HG21 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.043 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 0.15 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 0.11 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 0.2 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.444 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 0.9 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.632 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 0.2 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.716 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 1.99 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 0.13 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 0.26 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.29 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.722 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.15 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.22 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 0.2 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.45 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 0.18 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 1.87 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.774 HG21 ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.16 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 0.26 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 0.09 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.555 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.29 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 0.09 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 0.07 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.635 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 1.66 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 0.06 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.33 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 0.1 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.498 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.969 -0.452 . . . . 22.48 111.969 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 m80 58.65 34.69 24.0 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.065 0.546 . . . . 23.33 111.36 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.3 mtp -107.49 15.61 24.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 22.11 110.036 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 60.1 87.06 0.09 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 114.841 -1.072 . . . . 20.59 111.086 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -71.35 98.47 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.759 -0.655 . . . . 18.37 110.345 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -129.76 -156.66 0.77 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 16.65 109.956 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -83.19 -33.67 26.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.085 0.469 . . . . 17.53 110.177 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.2 m -82.54 106.77 14.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.946 -0.57 . . . . 15.09 110.418 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.2 m -77.55 128.36 34.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.788 0.327 . . . . 13.75 110.921 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -84.59 104.37 14.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.137 0.494 . . . . 14.58 110.183 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.458 ' HG2' ' H ' ' A' ' 11' ' ' GLU . 3.0 pt-20 -86.77 110.32 19.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.604 -0.726 . . . . 13.16 111.286 -176.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 64.0 mt -78.1 116.7 22.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.819 -0.628 . . . . 10.1 109.941 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.69 -168.37 1.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.848 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 83.3 m 70.76 -79.03 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.47 0.481 . . . . 7.42 111.167 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.8 t 54.03 -149.37 0.43 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.172 0.189 . . . . 6.06 110.927 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 63.57 78.74 0.28 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.224 0.61 . . . . 6.06 111.101 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m 62.03 -169.35 0.18 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.907 -1.042 . . . . 2.91 110.986 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 74.4 p -85.28 -176.16 6.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.946 0.403 . . . . 1.44 110.091 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.46 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 8.0 m -109.55 149.55 29.48 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.062 -1.088 . . . . 1.25 108.062 168.251 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.811 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -75.12 -175.83 2.79 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 122.288 1.042 . . . . 0.39 111.622 -174.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -129.66 154.59 46.98 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 113.546 -1.661 . . . . 0.43 107.109 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.7 mp0 -78.83 -10.66 59.86 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.01 -0.676 . . . . 1.0 111.296 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -83.26 -10.89 58.29 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.306 -0.998 . . . . 1.36 108.306 169.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.646 ' HB3' HD13 ' A' ' 62' ' ' LEU . 85.2 m-20 -98.24 -45.63 6.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.377 -1.283 . . . . 1.27 109.431 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.506 HG22 HD11 ' A' ' 62' ' ' LEU . 55.3 t -87.67 -52.83 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 113.741 -1.572 . . . . 1.01 112.977 -167.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.664 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.13 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 0.2 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 0.53 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.586 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.15 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 0.1 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.725 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.604 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.11 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.668 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 0.17 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.36 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.468 ' O ' HG23 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.15 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 0.66 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 0.21 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 0.1 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.712 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 0.09 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 35' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 1.95 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.32 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.675 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.82 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.416 ' HD2' ' N ' ' A' ' 49' ' ' PHE . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.13 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.581 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 1.47 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 0.09 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.25 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.718 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 0.1 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.498 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 0.82 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.718 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.14 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.785 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 0.16 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.825 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 0.11 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.815 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 1.92 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 0.14 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.815 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.425 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.27 109.037 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.05 112.095 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.811 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.825 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.0 t60 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.17 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 0.22 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.771 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 0.21 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.474 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 0.11 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.35 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.18 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.771 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.02 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 0.25 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.1 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.725 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 0.04 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.714 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.07 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.434 HG22 HG22 ' A' ' 119' ' ' THR . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 0.07 110.586 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.733 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.8 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.712 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 0.06 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.714 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 0.95 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.617 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 0.05 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.835 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 0.05 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.9 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.617 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 0.05 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 0.12 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.717 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.679 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 2.94 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.14 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.924 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.06 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.835 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 0.1 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 0.14 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.668 ' C ' HG21 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.025 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 0.15 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.924 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 0.11 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.516 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 0.2 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 0.9 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 0.2 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.679 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 1.99 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.52 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 0.13 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 0.26 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.29 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.15 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.22 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 0.2 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 0.18 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 1.87 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.733 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.16 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.837 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 0.26 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.761 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 0.09 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.837 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.29 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 0.09 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 0.07 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.647 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 1.66 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.717 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 0.06 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.674 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.09 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.33 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 0.1 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.52 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.961 -0.456 . . . . 22.48 111.961 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -114.56 21.98 14.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 23.33 110.978 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.49 -23.77 25.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.516 -0.311 . . . . 22.11 110.694 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 67.54 -76.1 0.06 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.922 0.764 . . . . 20.59 111.568 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.3 t -90.03 59.89 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.501 0.667 . . . . 18.37 109.95 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.42 18.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 16.65 110.837 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -100.51 -31.83 11.08 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.136 -0.484 . . . . 17.53 110.953 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 32.2 m 67.15 -70.45 0.11 Allowed 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.96 0.788 . . . . 15.09 111.085 -178.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 27.1 m -153.19 132.74 12.97 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.991 -0.744 . . . . 13.75 108.991 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 1.08 5.87 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.694 -0.402 . . . . 14.58 111.224 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.92 149.4 51.66 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.935 -0.394 . . . . 13.16 109.935 177.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 65.5 mt -80.04 80.95 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.396 0.617 . . . . 10.1 110.091 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -129.72 -179.16 5.03 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.725 -0.67 . . . . 10.66 109.866 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.5 m 54.6 33.27 18.78 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.836 0.827 . . . . 7.42 111.042 172.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m -88.08 71.91 9.24 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.773 -0.649 . . . . 6.06 110.447 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -122.44 -64.09 1.22 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.368 -0.833 . . . . 6.06 110.216 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 53.6 m -91.04 -165.91 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.967 -0.56 . . . . 2.91 110.479 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.545 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 81.5 p -72.77 -159.64 0.06 Allowed 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.611 0.243 . . . . 1.44 110.674 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.553 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 40.6 m -118.15 147.41 43.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.293 -0.632 . . . . 1.25 109.293 167.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.27 -170.32 1.42 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 122.071 0.939 . . . . 0.39 111.578 -175.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 m-80 -131.43 155.64 46.98 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 113.807 -1.542 . . . . 0.43 106.982 -173.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.9 mp0 -77.47 -13.07 60.0 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 118.975 0.807 . . . . 1.0 110.959 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.7 t -81.03 -11.9 59.45 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.986 -1.116 . . . . 1.36 107.986 171.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.628 ' HB3' HD13 ' A' ' 62' ' ' LEU . 67.7 m-20 -98.21 -45.21 6.28 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 114.206 -1.361 . . . . 1.27 109.155 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.52 HG22 HD11 ' A' ' 62' ' ' LEU . 50.7 t -88.55 -51.46 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 113.591 -1.641 . . . . 1.01 113.041 -166.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.648 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.13 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.64 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 0.2 110.91 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 0.53 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.604 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.15 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 0.1 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.11 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 0.17 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.563 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.36 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.563 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.15 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.582 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 0.66 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.498 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 0.21 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.085 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 0.1 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 0.09 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 1.95 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.844 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.32 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.544 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.6 mm-40 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.82 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.13 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.65 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 1.47 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 0.09 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.25 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.689 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 0.1 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 0.82 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.14 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.767 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 0.11 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 1.92 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 0.14 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.412 ' O ' ' HB3' ' A' ' 17' ' ' SER . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.514 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.27 109.288 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.05 111.806 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.765 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.806 ' CE1' HD13 ' A' ' 59' ' ' LEU . 64.4 t60 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.17 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 0.22 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 0.21 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 0.11 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.35 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.18 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.02 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 0.25 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.607 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.1 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 0.04 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.07 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 119' ' ' THR . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 0.07 110.619 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.728 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 0.06 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 0.95 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 0.05 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.738 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 0.05 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.628 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.8 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 0.05 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 0.12 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.684 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 2.94 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.14 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.855 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.06 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.738 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 0.1 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 0.14 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.085 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 0.15 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.855 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 0.11 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.497 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 0.2 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 0.9 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.674 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 0.2 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.684 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 1.99 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 0.26 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.29 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.15 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.22 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.467 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 0.18 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 1.87 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.728 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.16 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.803 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 0.26 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.801 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.732 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 0.09 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.589 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.803 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.29 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 0.09 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 0.07 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.666 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 1.66 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 0.06 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.705 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.09 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.33 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 0.1 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 111.684 -0.566 . . . . 22.48 111.684 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -78.03 -25.37 47.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.085 0.469 . . . . 23.33 110.064 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.2 mtp -148.81 127.02 12.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.527 -0.761 . . . . 22.11 109.98 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -83.51 67.33 9.33 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.128 0.49 . . . . 20.59 109.861 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.0 t 69.42 -73.86 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 114.949 -1.023 . . . . 18.37 110.797 -175.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 54.19 77.55 0.19 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.0 -0.545 . . . . 16.65 111.196 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -65.21 -10.48 32.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.013 -0.539 . . . . 17.53 111.812 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -80.51 7.86 9.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.987 0.422 . . . . 15.09 110.76 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.2 m -95.91 112.22 24.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.21 -0.45 . . . . 13.75 110.86 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 63.68 0.8 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.433 0.635 . . . . 14.58 109.426 177.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -164.88 160.66 19.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.229 -0.896 . . . . 13.16 108.606 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -74.02 82.32 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.532 0.682 . . . . 10.1 111.096 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -136.85 -46.91 0.59 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.224 -0.898 . . . . 10.66 110.132 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.9 m -66.24 162.72 19.38 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 7.42 110.41 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB2' ' OG1' ' A' ' 19' ' ' THR . 46.6 m -54.6 159.55 2.11 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.222 0.534 . . . . 6.06 111.725 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -63.95 126.56 28.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.508 -0.769 . . . . 6.06 111.528 -175.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.5 m 66.73 -168.37 0.2 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 124.005 0.816 . . . . 2.91 111.044 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 3.7 p -61.22 129.17 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.104 0.478 . . . . 1.44 111.077 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.588 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 25.7 m -128.86 147.86 50.85 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.314 0.578 . . . . 1.25 110.478 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.623 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -81.48 164.4 22.04 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 122.083 0.944 . . . . 0.39 111.788 -175.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.5 m-80 -104.55 159.72 15.52 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 113.075 -1.875 . . . . 0.43 107.941 -174.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.64 -14.09 59.49 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 119.778 -0.769 . . . . 1.0 110.909 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -80.69 -11.33 59.64 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.26 -1.015 . . . . 1.36 108.26 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.633 ' HB3' HD13 ' A' ' 62' ' ' LEU . 75.6 m-20 -97.12 -44.66 6.86 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.201 -1.363 . . . . 1.27 108.907 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.529 HG22 HD11 ' A' ' 62' ' ' LEU . 66.9 t -89.91 -54.75 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 113.604 -1.635 . . . . 1.01 113.154 -167.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.572 ' CE1' HD13 ' A' ' 55' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.576 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 0.2 111.015 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 0.53 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.725 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.15 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 0.1 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.611 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.11 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.637 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 0.17 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.585 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.36 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.585 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.15 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 0.66 110.532 174.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 0.21 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.008 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 0.1 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.772 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 0.09 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.421 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 1.95 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.32 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 76.1 mm-40 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.82 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.4 ' N ' ' CD2' ' A' ' 49' ' ' PHE . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.13 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.58 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 1.47 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 0.09 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.25 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.677 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.572 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 0.1 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 0.82 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.14 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 0.16 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.751 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 0.11 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 1.92 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 0.14 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.437 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.27 109.125 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.05 112.191 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.751 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.7 t60 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.17 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 0.22 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.809 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 0.21 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 0.11 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.721 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.35 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.18 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.02 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 0.25 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.721 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.1 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.746 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 0.04 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.07 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 0.07 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.787 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.772 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 0.06 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.692 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 0.95 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 0.05 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.764 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 0.05 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.617 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.8 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.579 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 0.05 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.716 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 0.12 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 2.94 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.716 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.14 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.88 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.06 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.764 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 0.14 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.637 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.008 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 0.15 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.88 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.503 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.773 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 0.2 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 0.9 109.272 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 0.2 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' HG3' ' A' ' 93' ' ' GLU . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 1.99 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 0.13 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.633 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 0.26 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.29 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.15 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.22 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.7 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 0.2 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 0.18 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 1.87 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.16 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.561 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.814 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 0.26 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.752 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 0.09 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.568 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.814 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.29 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 0.09 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 0.07 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.634 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 1.66 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.706 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 0.06 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.7 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.09 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.33 110.264 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 0.1 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.634 -0.586 . . . . 22.48 111.634 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -80.46 94.93 6.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.828 0.347 . . . . 23.33 110.151 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.7 ptp -115.02 -13.19 11.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 22.11 111.307 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.454 HE21 ' HA ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -155.56 132.44 10.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.585 0.231 . . . . 20.59 110.745 -174.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.3 m -123.34 -4.28 7.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.541 -0.3 . . . . 18.37 111.427 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.96 177.99 7.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.521 -0.309 . . . . 16.65 110.444 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.76 -50.12 63.75 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.197 -0.668 . . . . 17.53 109.197 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.504 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 25.0 m 61.08 90.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.447 -0.797 . . . . 15.09 112.363 171.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.9 t -70.54 -24.01 62.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.463 -0.789 . . . . 13.75 110.648 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -153.27 25.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.723 -0.473 . . . . 14.58 109.723 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 8' ' ' SER . 2.8 mp0 66.09 158.55 0.12 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.725 -0.671 . . . . 13.16 111.594 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -103.22 76.01 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.933 -0.576 . . . . 10.1 110.109 174.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -131.66 -60.23 0.94 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.778 -0.646 . . . . 10.66 110.16 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.0 t -100.3 -21.22 15.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.717 -0.674 . . . . 7.42 110.339 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m -68.41 123.91 22.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 6.06 110.843 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -118.85 59.39 0.83 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.697 -0.482 . . . . 6.06 109.697 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.1 m 67.56 -79.8 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.565 -0.743 . . . . 2.91 111.118 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.6 p -151.97 138.61 18.75 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.892 -0.781 . . . . 1.44 108.892 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 27.6 m -126.74 146.92 50.04 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.588 0.709 . . . . 1.25 111.531 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.72 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.35 -177.35 4.04 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.421 -1.263 . . . . 0.39 111.59 -177.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.1 m-80 -124.52 156.76 36.76 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.529 -1.669 . . . . 0.43 107.175 -174.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.31 -14.44 59.74 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.829 -0.748 . . . . 1.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 t -82.19 -9.17 59.6 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.866 -1.161 . . . . 1.36 107.866 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.647 ' HB3' HD13 ' A' ' 62' ' ' LEU . 67.6 m-20 -96.92 -46.98 6.01 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.456 -1.247 . . . . 1.27 108.657 174.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.524 HG22 HD11 ' A' ' 62' ' ' LEU . 54.8 t -86.41 -52.74 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 113.224 -1.807 . . . . 1.01 113.003 -165.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.573 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.13 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 0.2 111.019 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 0.53 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.15 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 0.1 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.11 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.716 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 0.17 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.36 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.15 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 0.66 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.551 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 0.21 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.077 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 0.1 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.725 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 0.09 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 1.95 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.911 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.32 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 23.3 mm-40 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.82 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.13 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 1.47 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 0.09 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.25 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.701 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.573 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 0.1 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 0.82 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.701 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.14 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 0.16 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.828 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 0.11 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.747 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 1.92 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 0.14 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.867 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.504 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.27 109.447 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.05 112.017 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.72 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.867 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 65.1 t60 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.17 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 0.22 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 0.21 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.449 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 0.11 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.644 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.35 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.18 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.02 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.515 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 0.25 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.1 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 0.04 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.07 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 119' ' ' THR . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 0.07 110.458 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.8 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.725 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 0.06 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.665 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 0.95 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 0.05 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 0.05 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.623 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.5 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 0.05 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 0.12 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.717 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.713 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.707 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 2.94 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.14 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.06 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 0.1 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.911 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 0.14 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.716 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.077 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 0.15 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 0.11 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.501 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.835 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 0.2 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 0.9 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.624 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 0.2 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.707 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 1.99 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.567 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 0.13 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.661 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.29 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.717 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.15 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.22 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 0.2 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 0.18 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 1.87 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.778 HG21 ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.16 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 0.26 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.769 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 0.09 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.29 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 0.09 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.769 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 0.07 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 1.66 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.713 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 0.06 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.09 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.33 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.835 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 0.1 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.567 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 112.308 -0.317 . . . . 22.48 112.308 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -83.75 138.01 33.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.844 0.355 . . . . 23.33 111.065 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.4 ttp -151.95 -61.14 0.16 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.959 -0.564 . . . . 22.11 109.784 178.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -164.72 127.75 2.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.368 -0.833 . . . . 20.59 108.768 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.0 t 67.38 90.46 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 O-C-N 123.788 0.68 . . . . 18.37 110.137 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.69 90.12 0.76 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.037 -0.529 . . . . 16.65 110.668 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -60.77 -40.78 93.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.626 -0.715 . . . . 17.53 110.585 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.1 p -86.08 61.85 7.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.063 -0.517 . . . . 15.09 109.712 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.6 m -58.53 97.14 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.631 -0.713 . . . . 13.75 112.022 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -95.26 -14.93 23.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.923 -0.58 . . . . 14.58 109.948 177.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -64.64 142.33 58.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.341 -0.845 . . . . 13.16 109.929 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -76.98 81.23 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.135 0.493 . . . . 10.1 110.25 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.15 156.7 48.02 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.684 -0.689 . . . . 10.66 109.384 177.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 p -116.98 134.4 54.79 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.696 0.284 . . . . 7.42 110.756 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.5 m -81.83 52.57 1.96 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.51 0.672 . . . . 6.06 110.391 178.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.54 135.99 38.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.279 -0.873 . . . . 6.06 109.542 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.9 m -73.55 166.39 23.34 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.368 . . . . 2.91 111.261 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 p -53.52 147.62 10.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.391 -0.822 . . . . 1.44 112.431 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.557 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 9.9 m -135.49 145.77 47.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.061 -0.518 . . . . 1.25 110.516 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -80.92 169.57 17.37 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 122.062 0.934 . . . . 0.39 111.351 -178.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.5 m-80 -108.64 142.52 39.0 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 113.506 -1.679 . . . . 0.43 106.88 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.483 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.8 mp0 -68.29 -13.0 61.94 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 119.21 0.914 . . . . 1.0 111.159 -178.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 p -79.52 -8.32 59.07 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.535 -0.913 . . . . 1.36 108.535 170.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HB3' HD13 ' A' ' 62' ' ' LEU . 79.0 m-20 -99.21 -47.42 5.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 114.421 -1.263 . . . . 1.27 108.421 176.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.522 HG13 ' O ' ' A' ' 21' ' ' ASN . 1.6 m -92.86 -40.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-N 114.892 -1.049 . . . . 1.01 113.476 -166.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.13 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.642 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 0.53 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.63 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.15 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 0.1 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.585 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.11 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.626 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 0.17 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.36 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.574 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.15 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.63 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 0.66 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.462 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 0.21 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.983 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 0.1 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.754 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 0.09 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HG2' HG22 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 1.95 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.32 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 80.1 mm-40 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.82 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.428 ' N ' ' HD2' ' A' ' 49' ' ' PHE . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.13 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 1.47 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 0.09 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.25 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.664 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.639 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 0.1 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.605 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 0.82 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.14 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.771 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 0.16 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.745 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 0.11 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.69 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.686 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 1.92 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 0.14 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.69 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.478 ' HB3' ' C ' ' A' ' 19' ' ' THR . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.27 109.55 -179.454 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.557 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.05 111.864 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.648 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.745 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.1 t60 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.17 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 0.22 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.834 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 0.21 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.445 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 0.11 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.35 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.18 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.834 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.02 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.438 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 0.25 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.1 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 0.04 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.07 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.494 HG22 HG22 ' A' ' 119' ' ' THR . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 0.07 110.743 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.766 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.0 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.754 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 0.06 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 0.95 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 0.05 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.784 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 0.05 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.632 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.623 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 0.05 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.696 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 0.12 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.72 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.703 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.706 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 2.94 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.696 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.14 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.888 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.06 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.784 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 0.1 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 0.14 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.626 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.983 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 0.15 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.888 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 0.11 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.507 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 0.2 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 0.9 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.64 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 0.2 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.706 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 1.99 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 0.13 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 0.26 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.29 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.72 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.15 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.22 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.485 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 0.18 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 1.87 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.16 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.859 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 0.26 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.797 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.748 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 0.09 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HA ' HD12 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.859 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.29 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 0.09 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 0.07 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.651 ' HB3' HD22 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 1.66 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.703 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 0.06 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.09 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.33 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 0.1 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.946 -0.461 . . . . 22.48 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 58.29 48.79 12.02 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.51 0.671 . . . . 23.33 110.356 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.483 ' CE ' ' HA ' ' A' ' 3' ' ' MET . 0.9 OUTLIER -116.77 68.7 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.741 -0.663 . . . . 22.11 109.953 176.708 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -72.22 110.67 6.83 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.164 -0.925 . . . . 20.59 109.229 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 8' ' ' SER . 9.3 m -82.95 96.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.631 0.729 . . . . 18.37 111.068 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.88 -22.84 15.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.749 . . . . 16.65 110.749 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 2.7 tmt_? -83.89 -39.84 19.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.323 -0.621 . . . . 17.53 109.323 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 5' ' ' VAL . 7.0 p -119.2 141.47 48.86 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.491 -0.777 . . . . 15.09 110.796 -178.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.5 m 72.43 -77.77 0.05 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.188 -0.46 . . . . 13.75 111.895 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? 53.84 52.09 13.66 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.054 0.542 . . . . 14.58 111.204 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -99.75 145.85 27.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.961 0.41 . . . . 13.16 111.266 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.5 mt -95.31 89.7 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.061 -0.518 . . . . 10.1 110.333 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -125.43 173.28 8.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.248 0.547 . . . . 10.66 111.379 -176.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 p -112.11 83.83 1.86 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.258 -0.883 . . . . 7.42 110.876 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.4 m -71.39 94.54 1.25 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.807 -0.633 . . . . 6.06 111.012 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -163.18 -72.33 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.777 -0.647 . . . . 6.06 110.19 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m -156.78 -168.61 2.72 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.933 -0.576 . . . . 2.91 109.562 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.416 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 24.5 p -62.01 -73.58 0.1 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.469 0.652 . . . . 1.44 109.725 171.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.623 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.1 m 63.39 146.66 0.02 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.927 -1.488 . . . . 1.25 113.309 173.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.73 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -91.96 -172.93 3.32 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.352 -1.294 . . . . 0.39 112.175 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 14.7 m-80 -128.86 158.35 38.99 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.328 -1.76 . . . . 0.43 107.097 -174.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.8 mp0 -79.8 -14.62 58.57 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 118.849 0.75 . . . . 1.0 111.592 -176.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.8 m -81.34 -9.54 59.73 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.036 -1.098 . . . . 1.36 108.036 170.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.584 ' HB3' HD13 ' A' ' 62' ' ' LEU . 80.2 m-20 -98.47 -43.66 6.8 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.058 -1.428 . . . . 1.27 109.305 176.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t -91.06 -54.21 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 113.986 -1.461 . . . . 1.01 112.928 -168.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.463 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.619 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.629 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 0.2 111.156 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 0.53 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.15 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 0.1 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.627 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.11 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 0.17 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.36 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.15 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 0.66 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.486 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 0.21 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.009 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 0.1 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 0.09 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 1.95 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.32 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.561 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.3 mm-40 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.82 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.469 ' N ' ' HD2' ' A' ' 49' ' ' PHE . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.13 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.62 ' CD ' HD11 ' A' ' 31' ' ' LEU . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 1.47 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.627 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 0.09 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.25 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.619 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 0.1 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 0.82 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.7 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.14 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 0.16 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.762 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 0.11 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.772 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 1.92 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.784 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 0.14 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.772 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.623 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.27 109.704 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.05 110.246 177.583 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.73 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.762 ' CE1' HD13 ' A' ' 59' ' ' LEU . 64.1 t60 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.17 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 0.22 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.819 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 0.21 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 0.11 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.35 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.18 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.819 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.02 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.414 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 0.25 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.1 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.756 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 0.04 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.07 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.437 HG22 HG22 ' A' ' 119' ' ' THR . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 0.07 110.555 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.705 ' HA ' HG21 ' A' ' 119' ' ' THR . 18.4 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 0.06 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 0.95 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 0.05 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.801 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 0.05 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.6 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 0.05 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.721 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 0.12 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.733 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.717 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 2.94 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.721 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.14 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.875 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.06 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.801 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 0.1 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 0.14 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.009 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 0.15 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.875 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 0.11 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.532 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 0.2 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 0.9 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.625 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 0.2 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.717 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 1.99 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 0.13 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 0.26 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.29 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.733 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.15 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.22 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 0.2 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.48 HG21 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 0.18 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 1.87 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.705 HG21 ' HA ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.16 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 0.26 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.766 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 0.09 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.29 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 0.09 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 0.07 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.665 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 1.66 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 0.06 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.688 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.09 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.33 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 0.1 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.145 -0.382 . . . . 22.48 112.145 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -63.19 123.73 19.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.665 0.269 . . . . 23.33 110.633 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.9 ptp -104.46 153.75 20.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.304 0.574 . . . . 22.11 111.104 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -90.22 132.69 35.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.182 -0.917 . . . . 20.59 108.803 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.55 -37.48 58.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 120.932 0.396 . . . . 18.37 110.705 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.74 80.29 7.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.247 -0.649 . . . . 16.65 109.247 171.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.5 mtm180 -55.42 -49.93 71.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.501 -0.772 . . . . 17.53 110.991 -176.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.419 ' O ' ' HB ' ' A' ' 9' ' ' THR . 4.4 p -92.66 9.99 32.5 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.636 -0.711 . . . . 15.09 110.928 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 8' ' ' SER . 74.6 m 69.37 -70.87 0.13 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 115.812 -0.631 . . . . 13.75 110.886 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.48 -78.4 0.3 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.161 -0.681 . . . . 14.58 109.161 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 57.16 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.708 0.766 . . . . 13.16 112.402 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.25 98.18 6.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.505 -0.77 . . . . 10.1 110.068 176.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.28 1.66 6.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.922 0.391 . . . . 10.66 111.206 -177.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -97.39 -178.05 4.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.684 -0.487 . . . . 7.42 109.684 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 14' ' ' THR . 38.3 t -56.74 -36.4 69.7 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.614 -0.513 . . . . 6.06 109.614 172.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' HB3' ' O ' ' A' ' 15' ' ' SER . 47.8 tt0 74.56 -52.81 0.68 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.165 -0.925 . . . . 6.06 111.254 176.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 m -107.48 178.27 4.59 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.024 0.44 . . . . 2.91 110.222 175.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.8 p -88.11 136.92 32.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.497 -0.774 . . . . 1.44 111.527 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.431 ' C ' ' HB3' ' A' ' 65' ' ' SER . 4.0 m -127.85 144.68 51.09 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.899 -0.591 . . . . 1.25 110.658 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.741 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -73.36 -176.96 2.4 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.219 1.009 . . . . 0.39 111.497 -177.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.9 m-80 -128.3 149.52 50.46 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.589 -1.641 . . . . 0.43 106.86 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.409 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.7 mp0 -74.18 -12.84 60.69 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.824 -0.75 . . . . 1.0 111.532 -177.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.1 m -82.12 -10.8 59.06 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 108.352 -0.981 . . . . 1.36 108.352 171.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.622 ' HB3' HD13 ' A' ' 62' ' ' LEU . 76.8 m-20 -97.04 -46.09 6.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.268 -1.333 . . . . 1.27 108.821 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.557 HG22 HD11 ' A' ' 62' ' ' LEU . 59.1 t -84.47 -52.57 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 CA-C-N 113.281 -1.781 . . . . 1.01 112.776 -167.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.671 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.13 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 0.2 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 0.53 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.15 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 0.1 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.662 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.11 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.708 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 0.17 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.57 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.36 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.57 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.15 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.58 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 0.66 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 0.21 109.466 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.033 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 0.1 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.734 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 0.09 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 1.95 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.885 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.32 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 61.2 mm-40 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.82 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.13 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.637 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 1.47 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.664 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 0.09 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.25 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.69 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.537 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 0.1 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 0.82 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.69 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.14 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 0.16 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.807 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 0.11 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.714 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 1.92 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 0.14 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.891 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.443 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.27 109.863 -177.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.05 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.741 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.891 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 70.4 t60 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.17 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 0.22 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.794 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 0.21 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.464 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 0.11 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.662 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.35 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 77' ' ' SER . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.18 109.61 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.02 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 0.25 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.1 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 0.04 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.07 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.468 HG22 HG22 ' A' ' 119' ' ' THR . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 0.07 110.523 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.734 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 0.06 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 0.95 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 0.05 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.742 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 0.05 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 0.05 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 86' ' ' GLN . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 0.12 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.712 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.705 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.71 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 2.94 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.14 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.867 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.06 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.742 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 0.1 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.885 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 0.14 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.708 ' C ' HG21 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.033 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 0.15 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.867 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 0.11 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.52 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.765 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 0.2 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 0.9 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.662 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 0.2 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.71 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 1.99 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 0.13 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.629 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 0.26 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.29 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.712 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.15 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.22 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 0.2 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.496 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 0.18 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 1.87 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.704 HG21 ' HA ' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.16 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.535 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.832 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 0.26 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.804 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.794 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 0.09 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.832 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.29 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 0.09 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 0.07 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.686 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 1.66 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 0.06 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.09 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.33 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.765 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 0.1 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 111.939 -0.464 . . . . 22.48 111.939 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -134.75 84.66 2.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.967 -0.383 . . . . 23.33 109.967 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtt -127.83 -69.05 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 22.11 110.932 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -133.61 63.61 1.63 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 20.59 110.15 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.48 -25.75 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.953 0.406 . . . . 18.37 110.908 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 38.71 22.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.442 -0.799 . . . . 16.65 110.843 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -61.51 -29.21 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.594 -0.73 . . . . 17.53 111.556 -174.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -64.48 -26.62 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.386 -0.37 . . . . 15.09 111.115 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.8 m -104.99 -63.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.092 0.473 . . . . 13.75 110.463 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtpt -78.95 81.93 5.18 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.678 -0.692 . . . . 14.58 109.525 -177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.19 69.34 0.77 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.763 -1.108 . . . . 13.16 111.118 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.04 100.28 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.199 -0.91 . . . . 10.1 109.663 175.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -125.53 -62.4 1.2 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.234 -0.439 . . . . 10.66 110.494 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -165.66 -51.82 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.217 -0.447 . . . . 7.42 111.129 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 p -172.35 79.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.019 0.438 . . . . 6.06 110.36 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -94.08 -64.86 1.03 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.064 -0.516 . . . . 6.06 110.088 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 p -162.41 -90.66 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 2.91 110.315 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.523 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 5.9 p -157.13 -81.78 0.06 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.823 0.82 . . . . 1.44 109.67 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.613 ' C ' ' HB3' ' A' ' 65' ' ' SER . 12.5 m 63.25 152.34 0.04 OUTLIER 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 113.307 -1.77 . . . . 1.25 112.353 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.856 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -92.39 -167.0 1.66 Allowed 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 114.649 -1.16 . . . . 0.39 111.743 -173.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 3.5 m-80 -114.03 141.12 47.83 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 106.048 -1.834 . . . . 0.43 106.048 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.557 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.5 mp0 -75.34 -11.34 60.03 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 119.421 -0.912 . . . . 1.0 110.348 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 p -82.6 -8.56 59.6 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 108.445 -0.946 . . . . 1.36 108.445 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.601 ' OD1' ' HB3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -94.68 -54.35 3.53 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 123.03 1.395 . . . . 1.27 108.72 173.898 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.693 HG21 ' HG3' ' A' ' 67' ' ' GLU . 55.5 t -72.17 -44.66 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 CA-C-N 111.956 -2.384 . . . . 1.01 110.86 -163.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.13 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.677 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 0.2 110.911 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.687 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 0.53 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.693 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.15 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 0.1 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.659 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.11 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.67 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 0.17 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.36 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.15 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.46 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 0.66 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 0.21 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.046 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 0.1 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 0.09 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 1.95 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.32 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 81.8 mm-40 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.82 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.414 ' HD2' ' N ' ' A' ' 49' ' ' PHE . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.13 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.642 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 1.47 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 0.09 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.25 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 0.1 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 0.82 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.14 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.721 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 0.16 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.825 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 0.11 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.704 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 1.92 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.721 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 0.14 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.881 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.613 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.27 109.432 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.05 110.636 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.856 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.881 ' CE1' ' HG2' ' A' ' 63' ' ' GLU . 71.1 t60 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.17 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 0.22 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 0.21 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 0.11 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.35 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.18 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.02 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 0.25 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.1 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 0.04 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.724 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.07 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 0.07 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.745 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.5 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.742 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 0.06 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 0.95 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 0.05 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.793 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 0.05 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.561 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.605 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 0.05 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 0.12 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.696 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 2.94 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.693 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.14 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.06 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.793 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 0.1 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 0.14 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.67 ' C ' HG21 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.046 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 0.15 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 0.11 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.489 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 0.2 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 0.9 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.673 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 0.2 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.705 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 1.99 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 0.13 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.653 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 0.26 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.29 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.696 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.15 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.22 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 0.2 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 0.18 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 1.87 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.745 HG21 ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.16 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 0.26 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 0.09 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.29 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 0.09 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 0.07 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.588 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 1.66 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 0.06 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.33 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 0.1 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.106 -0.398 . . . . 22.48 112.106 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -98.87 29.76 3.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 23.33 111.116 -177.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ptm -133.67 32.74 3.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.056 0.455 . . . . 22.11 110.665 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -76.18 142.62 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.757 -0.46 . . . . 20.59 109.757 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.4 m -79.23 112.91 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.625 0.726 . . . . 18.37 111.057 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.509 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -84.67 60.67 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.551 -0.75 . . . . 16.65 110.403 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -66.19 -19.18 65.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.465 -0.789 . . . . 17.53 112.209 -173.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.5 m -122.9 25.1 8.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.056 0.455 . . . . 15.09 110.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.509 ' HB ' ' HB1' ' A' ' 6' ' ' ALA . 4.0 m -115.39 168.35 10.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.713 -0.477 . . . . 13.75 109.713 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' H ' HG22 ' A' ' 9' ' ' THR . 22.6 tptm 71.37 28.62 2.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 121.844 0.831 . . . . 14.58 110.188 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -127.7 109.89 12.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.599 -0.728 . . . . 13.16 110.152 177.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.75 90.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.567 0.698 . . . . 10.1 110.1 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.41 ' O ' ' HB ' ' A' ' 14' ' ' THR . 45.0 mt-10 -125.25 -163.92 1.24 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.548 -0.751 . . . . 10.66 110.518 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 13' ' ' GLU . 44.0 m 76.89 -51.93 0.57 Allowed 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.983 0.802 . . . . 7.42 111.941 173.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.7 m -77.54 39.92 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.151 0.501 . . . . 6.06 111.179 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -133.9 1.52 3.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.402 0.62 . . . . 6.06 109.71 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 19' ' ' THR . 22.0 t -170.82 -168.6 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 2.91 108.965 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.639 ' O ' ' HA ' ' A' ' 65' ' ' SER . 7.0 t -87.2 22.69 2.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.37 1.081 . . . . 1.44 109.589 176.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.537 ' HA ' ' CG ' ' A' ' 66' ' ' ARG . 16.9 m -37.79 143.2 0.12 Allowed 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 112.528 -2.123 . . . . 1.25 114.009 -177.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.701 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -71.54 177.85 3.82 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.295 -1.775 . . . . 0.39 111.758 -178.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 6.8 m-80 -112.15 156.5 22.17 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.472 -1.694 . . . . 0.43 107.674 -176.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.9 mp0 -77.31 -12.42 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 119.788 -0.765 . . . . 1.0 110.376 178.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.0 m -79.59 -12.41 59.84 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.213 -1.032 . . . . 1.36 108.213 171.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.692 ' HB3' HD13 ' A' ' 62' ' ' LEU . 51.6 m-20 -97.18 -47.67 5.66 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.341 -1.299 . . . . 1.27 108.948 175.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.564 HG22 HD11 ' A' ' 62' ' ' LEU . 53.7 t -85.51 -53.15 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 113.267 -1.788 . . . . 1.01 113.251 -164.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.543 ' CE1' HD13 ' A' ' 55' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.13 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.592 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 0.2 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 0.53 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.15 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 0.1 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.11 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 0.17 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.36 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.54 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.15 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.64 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 0.66 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.592 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 0.21 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.035 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 0.1 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 0.09 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 1.95 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.32 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.82 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.443 ' CE2' ' HB ' ' A' ' 82' ' ' ILE . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.13 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 1.47 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.672 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 0.09 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.25 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.693 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.574 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 0.1 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 0.82 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.14 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.76 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 0.16 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.738 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 0.11 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 1.92 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 0.14 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.681 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' THR . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.27 109.056 178.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.601 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.05 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.701 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.738 ' CE1' HD13 ' A' ' 59' ' ' LEU . 65.8 t60 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.17 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 0.22 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 0.21 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.465 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 0.11 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.35 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.18 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.02 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.432 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 0.25 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.729 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.1 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 0.04 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.07 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 0.07 110.544 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.783 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 0.06 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 0.95 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.615 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 0.05 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.748 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 0.05 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.602 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.0 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.518 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.615 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 0.05 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 0.12 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.713 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.685 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 2.94 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.14 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.842 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.06 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.748 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 0.1 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 0.14 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.035 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 0.15 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.842 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 0.11 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.819 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 0.2 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 0.9 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.636 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 0.2 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.711 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 1.99 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 0.13 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 0.26 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.29 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.713 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.15 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.22 108.094 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.698 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 0.2 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.5 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 0.18 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 1.87 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.16 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.592 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 0.26 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 0.09 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.579 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.29 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 0.09 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 0.07 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.636 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 1.66 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 0.06 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.09 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.33 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.819 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 0.1 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 112.25 -0.34 . . . . 22.48 112.25 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -60.32 -50.46 73.53 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.041 0.386 . . . . 23.33 112.041 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.5 mmt -77.35 -50.81 11.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.85 -0.34 . . . . 22.11 110.503 -177.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -143.24 153.28 42.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 20.59 110.17 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 ' OG ' ' A' ' 8' ' ' SER . 12.6 t -117.14 73.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.405 0.622 . . . . 18.37 109.698 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.29 -13.23 20.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.746 -0.661 . . . . 16.65 111.309 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.89 -4.57 44.48 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.794 0.294 . . . . 17.53 111.794 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.463 ' OG ' HG12 ' A' ' 5' ' ' VAL . 9.7 m -50.73 -53.48 31.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.198 0.444 . . . . 15.09 112.198 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.6 m -104.56 21.37 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.341 0.591 . . . . 13.75 110.535 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -103.15 63.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.153 0.501 . . . . 14.58 109.956 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -113.44 127.36 56.08 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.821 -0.627 . . . . 13.16 110.022 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.62 112.78 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.125 -0.489 . . . . 10.1 109.842 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.53 -56.33 1.89 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.831 -0.622 . . . . 10.66 110.011 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 t -116.4 125.27 51.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.571 -0.741 . . . . 7.42 110.063 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 13.6 m -119.56 127.23 52.8 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.722 -0.473 . . . . 6.06 109.722 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HB3' ' O ' ' A' ' 15' ' ' SER . 46.6 tt0 69.54 128.55 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.845 0.715 . . . . 6.06 110.903 -177.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 m -70.54 167.54 18.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 2.91 110.947 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.429 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 27.3 p -51.57 149.76 4.22 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.335 0.865 . . . . 1.44 113.335 -176.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.551 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 6.7 m -140.86 148.03 39.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.685 -0.688 . . . . 1.25 109.775 175.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -77.27 -176.22 4.03 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 122.312 1.053 . . . . 0.39 112.258 -174.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.5 m-80 -120.9 150.12 41.56 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.405 -1.725 . . . . 0.43 107.213 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -75.54 -11.95 60.13 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.412 -0.515 . . . . 1.0 111.27 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -81.67 -12.93 58.47 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 108.412 -0.959 . . . . 1.36 108.412 170.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.592 ' HB3' HD13 ' A' ' 62' ' ' LEU . 93.1 m-20 -97.94 -43.1 7.23 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.119 -1.4 . . . . 1.27 109.456 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.608 HG22 HD11 ' A' ' 62' ' ' LEU . 70.3 t -88.46 -55.45 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.032 -1.44 . . . . 1.01 112.65 -167.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.627 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.13 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.675 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 0.2 111.015 -176.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.967 ' HG ' HE22 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 0.53 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.15 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 0.1 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.726 ' CE2' HD12 ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.11 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.691 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 0.17 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.587 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.36 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.587 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.15 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 0.66 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.789 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 0.21 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.105 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 0.1 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.785 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 0.09 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 1.95 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.32 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 52.7 mm-40 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.82 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.411 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.13 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 1.47 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.683 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 0.09 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.25 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.967 HE22 ' HG ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 0.1 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.658 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 0.82 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.671 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.14 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.779 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 0.16 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.736 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 0.11 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.711 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.597 ' HE2' HD23 ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 1.92 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.779 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 0.14 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.544 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.27 109.312 178.07 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.05 110.784 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.779 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.736 ' CE1' HD13 ' A' ' 59' ' ' LEU . 67.3 t60 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.17 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 0.22 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.791 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 0.21 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.435 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 0.11 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.35 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.18 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.791 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.02 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.425 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 0.25 110.584 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.1 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.695 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 0.04 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.682 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.07 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 0.07 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.755 ' HA ' HG21 ' A' ' 119' ' ' THR . 21.6 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.785 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 0.06 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.682 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 0.95 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.629 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 0.05 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.781 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 0.05 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.633 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.4 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 0.05 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 0.12 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.725 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.692 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 2.94 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.14 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.861 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.06 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.781 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 0.1 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.412 -175.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.691 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.105 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 0.15 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.861 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 0.11 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.827 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 0.2 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 0.9 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 0.2 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.692 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 1.99 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.459 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 0.13 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 0.26 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.29 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.15 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.22 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 0.2 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.509 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 0.18 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 1.87 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.16 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.838 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 0.26 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.789 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 0.09 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.574 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.838 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.29 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 0.09 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 0.07 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.655 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 1.66 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.725 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 0.06 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.09 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.33 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 0.1 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.81 -0.516 . . . . 22.48 111.81 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -136.38 139.14 42.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.721 0.296 . . . . 23.33 110.223 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.4 tpt -106.17 124.06 48.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.314 -0.403 . . . . 22.11 110.256 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -100.62 96.59 7.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.221 -0.445 . . . . 20.59 110.477 -177.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.0 t -102.53 -58.55 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.094 0.473 . . . . 18.37 110.339 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.27 70.28 0.3 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.608 -0.724 . . . . 16.65 109.902 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 17.53 110.461 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m 69.87 133.67 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.926 0.766 . . . . 15.09 112.635 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 4.8 m -75.93 153.6 36.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.628 -0.714 . . . . 13.75 110.306 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 9' ' ' THR . 27.8 tptp 75.01 2.57 4.01 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.352 0.661 . . . . 14.58 110.306 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 70.16 147.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.11 -0.95 . . . . 13.16 111.727 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.0 mt -85.03 94.03 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.68 -0.691 . . . . 10.1 110.14 178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.62 -77.0 0.53 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.861 0.362 . . . . 10.66 111.089 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -94.71 -81.53 0.39 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.006 -0.543 . . . . 7.42 111.648 -175.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.9 m 55.82 41.03 30.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.424 0.631 . . . . 6.06 109.961 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -80.39 -57.47 3.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 6.06 111.129 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -140.76 -166.24 2.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.881 0.372 . . . . 2.91 111.06 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.573 ' OG1' ' HA ' ' A' ' 65' ' ' SER . 2.9 p -68.18 172.1 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.709 . . . . 1.44 112.027 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.544 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 91.9 m -128.78 -71.95 0.62 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.736 -0.665 . . . . 1.25 110.511 173.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . 175.4 -173.21 0.08 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 124.414 1.071 . . . . 0.39 112.114 176.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.503 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.7 m-80 -134.63 148.4 50.38 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 112.91 -1.95 . . . . 0.43 106.152 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.461 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.6 mp0 -79.75 -13.09 59.69 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 119.862 -0.735 . . . . 1.0 111.496 -176.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.7 t -82.47 -9.6 59.36 Favored 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 107.625 -1.25 . . . . 1.36 107.625 171.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 62' ' ' LEU . 94.7 m-20 -98.6 -44.06 6.6 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.282 -1.326 . . . . 1.27 109.385 176.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.527 HG23 ' HB1' ' A' ' 20' ' ' ALA . 53.8 t -86.9 -53.5 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.182 -1.372 . . . . 1.01 113.145 -170.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.675 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.13 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.549 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 0.2 110.801 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.673 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 0.53 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.15 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 0.1 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.653 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.11 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 0.17 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.36 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.613 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.15 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 0.66 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.515 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 0.21 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 0.1 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.764 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 0.09 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.539 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 1.95 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.32 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.547 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 34.0 mm-40 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.82 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.43 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.13 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 1.47 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 0.09 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.25 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.686 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 0.1 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.598 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 0.82 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.14 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.16 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.767 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 0.11 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.693 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 1.92 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.727 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 0.14 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.573 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.27 110.113 177.555 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.05 110.268 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.767 ' CE1' HD13 ' A' ' 59' ' ' LEU . 66.4 t60 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.17 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 0.22 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 0.21 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.441 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 0.11 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.35 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.18 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.02 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 0.25 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.584 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.1 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 0.04 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.07 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.453 HG22 HG22 ' A' ' 119' ' ' THR . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 0.07 110.622 179.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.78 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.764 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 0.06 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 0.95 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 0.05 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 0.05 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.64 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 0.05 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.7 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 0.12 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.686 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 2.94 107.334 173.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.14 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.849 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.06 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 0.1 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 0.14 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 0.15 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.849 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 0.11 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.806 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 0.2 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 0.9 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.642 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 0.2 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 1.99 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 0.13 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.636 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.29 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.686 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.15 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.22 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.703 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 0.2 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 0.18 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 1.87 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.16 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.794 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 0.26 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 0.09 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.29 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.8 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 0.09 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 0.07 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.65 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 1.66 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.691 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 0.06 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.703 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.09 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.33 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 0.1 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.845 -0.502 . . . . 22.48 111.845 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -90.28 -30.64 17.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.905 0.383 . . . . 23.33 110.335 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -138.42 -72.48 0.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.325 -0.398 . . . . 22.11 110.868 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 52.4 56.88 7.06 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.408 0.623 . . . . 20.59 110.394 -175.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.3 m -112.84 38.07 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.348 -0.842 . . . . 18.37 110.542 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.33 39.55 2.47 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.633 -0.712 . . . . 16.65 110.236 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -93.94 -6.74 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.602 -0.726 . . . . 17.53 110.944 -177.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.9 m -85.03 54.92 3.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.326 0.584 . . . . 15.09 109.863 177.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.2 p -81.22 154.92 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.581 -0.736 . . . . 13.75 111.872 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -99.4 13.2 34.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.566 -0.743 . . . . 14.58 110.129 178.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -96.68 159.86 14.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 13.16 109.375 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.3 mt -85.64 104.53 13.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.775 -0.454 . . . . 10.1 109.775 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -124.75 166.42 16.22 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.128 -0.487 . . . . 10.66 110.36 -177.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.4 m 69.48 125.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.81 0.694 . . . . 7.42 110.799 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t 65.69 68.21 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.252 0.549 . . . . 6.06 110.289 -178.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -66.58 131.95 47.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 6.06 109.828 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.6 m -75.86 178.47 6.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.327 -0.397 . . . . 2.91 111.143 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.2 p -51.61 135.36 28.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.686 -0.688 . . . . 1.44 111.977 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.58 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 50.3 m -127.0 147.75 50.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.2 0.524 . . . . 1.25 110.205 177.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.676 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.76 169.59 18.02 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 122.339 1.066 . . . . 0.39 111.612 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.7 m-80 -107.9 145.09 34.23 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.113 -1.858 . . . . 0.43 106.634 -176.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -69.81 -14.19 62.64 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 119.237 0.926 . . . . 1.0 111.25 -176.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.3 p -79.48 -7.44 58.44 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 108.174 -1.047 . . . . 1.36 108.174 170.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HB3' HD13 ' A' ' 62' ' ' LEU . 82.0 m-20 -98.75 -49.25 4.65 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.532 -1.213 . . . . 1.27 108.411 174.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.542 HG13 ' O ' ' A' ' 21' ' ' ASN . 1.7 m -91.22 -41.24 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.874 -1.057 . . . . 1.01 113.54 -166.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.649 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.13 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.591 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 0.2 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.686 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 0.53 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.708 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.15 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 0.1 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.603 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.11 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.689 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 0.17 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.36 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.15 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.484 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 0.66 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.483 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 0.21 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.013 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 0.1 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 0.09 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 1.95 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.32 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 84.1 mm-40 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.82 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.406 ' N ' ' CD2' ' A' ' 49' ' ' PHE . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.13 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.591 ' HD2' HD11 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 1.47 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 0.09 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.25 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.528 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 0.1 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 0.82 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.14 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 0.16 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.733 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 0.11 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.672 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 1.92 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 0.14 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.552 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.27 109.582 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.58 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.05 112.348 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.733 ' CE1' HD13 ' A' ' 59' ' ' LEU . 68.1 t60 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.17 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 0.22 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 0.21 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.442 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 0.11 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.35 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.18 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.02 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 0.25 110.776 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.1 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 0.04 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.688 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.07 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 119' ' ' THR . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 0.07 110.6 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.693 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.1 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 0.06 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 0.95 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.622 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 0.05 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 0.05 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.624 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 0.05 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 0.12 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.718 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.695 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 2.94 109.17 169.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.14 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.06 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 0.1 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 0.14 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.689 ' C ' HG21 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.013 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 0.15 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 0.11 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.51 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.811 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 0.2 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 0.9 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.583 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 0.2 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.695 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 1.99 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.531 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 0.13 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.632 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 0.26 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.29 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.15 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.22 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.681 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 0.2 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.435 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 0.18 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.443 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 1.87 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.16 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 0.26 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.815 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 0.09 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.29 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 0.09 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 0.07 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.6 ' HB3' HD22 ' A' ' 102' ' ' LEU . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 1.66 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 0.06 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.681 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.09 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.33 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 0.1 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.531 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.999 -0.44 . . . . 22.48 111.999 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -93.07 72.38 4.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 23.33 110.781 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 mmt 58.12 40.89 24.67 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.83 -0.623 . . . . 22.11 111.603 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -150.46 101.5 2.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.572 -0.74 . . . . 20.59 109.166 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.61 132.21 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.338 -0.846 . . . . 18.37 112.286 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.39 40.12 27.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.302 -0.863 . . . . 16.65 112.203 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -85.77 -34.16 21.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.942 0.401 . . . . 17.53 110.146 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -147.35 124.72 11.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.142 -0.481 . . . . 15.09 110.634 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -144.3 168.65 19.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.006 -0.739 . . . . 13.75 109.006 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG3' ' H ' ' A' ' 11' ' ' GLU . 47.0 pttt -57.16 -65.09 0.68 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.332 0.11 . . . . 14.58 111.084 -178.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.587 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 4.5 mm-40 -158.12 152.85 24.95 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.169 -0.678 . . . . 13.16 109.169 178.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.8 mt -112.82 73.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.23 0.538 . . . . 10.1 109.823 175.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -138.27 48.37 1.96 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.898 -0.592 . . . . 10.66 110.303 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.2 p -64.52 -66.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.683 -0.488 . . . . 7.42 109.683 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.9 m 50.03 42.36 24.61 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.693 0.62 . . . . 6.06 112.334 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -93.86 -40.59 10.08 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.475 0.655 . . . . 6.06 109.374 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 t -155.39 -72.32 0.12 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.034 -0.984 . . . . 2.91 108.593 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.692 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 5.6 p -154.83 145.8 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.945 -1.025 . . . . 1.44 109.003 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.482 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 12.5 m -136.81 22.17 3.09 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.658 1.218 . . . . 1.25 109.908 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.715 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . 67.41 -176.95 0.2 Allowed 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.245 -1.798 . . . . 0.39 111.827 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -123.36 155.35 37.51 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.891 -1.504 . . . . 0.43 107.356 -176.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.576 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.9 mp0 -76.89 -11.81 59.87 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 119.89 -0.724 . . . . 1.0 110.771 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.5 m -82.19 -11.35 58.75 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.454 -0.943 . . . . 1.36 108.454 171.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.661 ' HB3' HD13 ' A' ' 62' ' ' LEU . 85.2 m-20 -97.95 -45.83 6.14 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.479 -1.237 . . . . 1.27 109.302 175.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.505 HG22 HD11 ' A' ' 62' ' ' LEU . 42.6 t -85.7 -50.4 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 CA-C-N 113.129 -1.85 . . . . 1.01 112.491 -167.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.13 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 0.2 111.186 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 0.53 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.15 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 0.1 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.731 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.635 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.11 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.69 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 0.17 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.36 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.15 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 0.66 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.62 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 0.21 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.076 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 0.1 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 0.09 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.56 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 1.95 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.654 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.32 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.487 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 63.9 mm-40 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.82 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 46' ' ' ASN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.13 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.604 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 1.47 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 0.09 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.25 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.678 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 0.1 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 0.82 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.696 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.14 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 0.16 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.754 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 0.11 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.696 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 1.92 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 0.14 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.595 ' HA ' ' CB ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.27 109.905 177.767 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.692 ' HB3' ' O ' ' A' ' 18' ' ' THR . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.05 110.154 176.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.715 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.754 ' CE1' HD13 ' A' ' 59' ' ' LEU . 70.1 t60 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.17 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 0.22 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.74 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 0.21 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 0.11 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.35 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.18 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.74 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.02 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 0.25 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.1 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.731 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 0.04 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.07 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG22 ' A' ' 119' ' ' THR . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 0.07 110.808 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.72 ' HA ' HG21 ' A' ' 119' ' ' THR . 16.0 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 0.06 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 0.95 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.616 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 0.05 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 0.05 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.646 ' HG3' HD12 ' A' ' 82' ' ' ILE . 2.2 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.545 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 0.05 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 0.12 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.708 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 2.94 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.14 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.874 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.06 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.78 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 0.1 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.654 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 0.14 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.69 ' C ' HG21 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.076 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 0.15 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.874 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.489 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.86 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 0.2 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 0.9 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 0.2 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.678 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 1.99 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 0.13 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 0.26 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.29 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.15 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.22 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 0.2 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.473 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 0.18 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.402 ' HA ' ' CG ' ' A' ' 125' ' ' ASP . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 1.87 109.869 169.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.72 HG21 ' HA ' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.16 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.62 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.862 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 0.26 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.791 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 0.09 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.862 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.29 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 0.09 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 0.07 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.623 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 1.66 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.708 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 0.06 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.695 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.09 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.33 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.86 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 0.1 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.927 -0.469 . . . . 22.48 111.927 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 m80 56.42 43.27 26.37 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.404 0.621 . . . . 23.33 111.008 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.9 ttm -134.57 -32.13 1.03 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.297 -0.865 . . . . 22.11 109.665 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -91.83 62.23 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.508 0.671 . . . . 20.59 109.554 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.05 95.78 5.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.132 -0.692 . . . . 18.37 109.132 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.66 41.7 0.57 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.855 -0.611 . . . . 16.65 112.129 -171.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 -91.11 -14.61 30.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.3 0.571 . . . . 17.53 109.569 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.419 ' HB2' ' H ' ' A' ' 11' ' ' GLU . 2.6 p -111.58 132.69 54.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.441 -0.799 . . . . 15.09 110.903 -178.128 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -83.92 -30.89 25.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.098 -0.501 . . . . 13.75 110.716 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -144.21 9.25 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 14.58 110.826 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' H ' ' HB2' ' A' ' 8' ' ' SER . 40.9 tt0 71.09 138.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.465 -0.789 . . . . 13.16 110.65 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -73.07 103.35 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.091 -0.504 . . . . 10.1 110.427 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -127.81 -71.36 0.66 Allowed 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.111 -0.495 . . . . 10.66 110.613 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.6 m -102.57 83.83 2.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.507 0.67 . . . . 7.42 111.336 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 6.4 p -99.56 12.2 37.12 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.811 0.815 . . . . 6.06 108.943 172.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -101.83 133.69 46.19 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.703 -1.135 . . . . 6.06 110.845 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 m -67.95 -176.94 0.74 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.795 -0.639 . . . . 2.91 111.062 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.403 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 11.4 p -49.68 133.13 21.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.919 0.39 . . . . 1.44 111.416 177.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.481 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.6 m -143.98 149.85 37.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.304 0.573 . . . . 1.25 111.061 -176.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -81.39 178.1 8.57 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 122.205 1.002 . . . . 0.39 112.146 -173.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 13.1 m-80 -119.74 153.59 35.42 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.316 -1.766 . . . . 0.43 107.529 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.436 ' O ' ' HB3' ' A' ' 26' ' ' ASP . 2.9 mp0 -76.79 -13.15 60.05 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 120.023 -0.671 . . . . 1.0 111.027 -179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -80.34 -12.81 59.55 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.014 -1.106 . . . . 1.36 108.014 171.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.64 ' HB3' HD13 ' A' ' 62' ' ' LEU . 83.5 m-20 -97.38 -44.67 6.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.287 -1.324 . . . . 1.27 109.072 177.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.525 HG22 HD11 ' A' ' 62' ' ' LEU . 55.8 t -87.19 -53.19 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 113.434 -1.712 . . . . 1.01 112.994 -167.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.13 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.419 ' ND2' HG13 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.166 -174.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.671 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 0.53 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.767 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.15 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 0.1 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.586 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.11 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 0.17 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.36 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.15 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.709 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 0.66 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.754 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 0.21 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.137 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 0.1 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.751 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 0.09 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.523 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 1.95 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.32 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.522 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.1 mm-40 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.82 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' OE1' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.13 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.625 ' HB3' HD21 ' A' ' 31' ' ' LEU . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 1.47 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.662 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 0.09 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.25 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 0.1 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.625 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 0.82 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.14 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.747 ' O ' HD22 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 0.16 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.729 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 0.11 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.71 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 1.92 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 0.14 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.481 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.27 109.796 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.05 111.443 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.717 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.729 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.0 t60 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.17 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 0.22 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 0.21 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.555 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 0.11 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.35 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.18 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.02 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.544 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 0.25 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.1 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 0.04 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.07 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.446 HG22 HG22 ' A' ' 119' ' ' THR . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 0.07 110.586 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 19.5 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.751 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 0.06 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 0.95 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 0.05 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.817 HG23 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 0.05 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.58 ' HG3' HD12 ' A' ' 82' ' ' ILE . 3.1 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.05 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 0.12 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.719 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.686 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 2.94 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.14 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.893 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.06 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.817 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 0.1 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 0.14 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.137 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 0.15 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.893 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 0.11 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.506 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.831 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 0.2 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 0.9 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.651 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 0.2 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.686 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 1.99 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.517 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 0.13 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 0.26 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.29 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.719 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.15 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.22 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 0.2 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.47 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 0.18 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HA ' ' OD1' ' A' ' 125' ' ' ASP . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 1.87 109.609 169.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.16 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.88 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 0.26 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.754 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.742 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 0.09 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.88 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.29 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 0.09 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 0.07 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 1.66 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.716 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 0.06 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.09 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.33 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.831 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 0.1 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.874 -0.491 . . . . 22.48 111.874 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -111.15 119.79 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.437 -0.579 . . . . 23.33 109.437 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.7 mmt 71.12 106.23 0.06 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.14 0.9 . . . . 22.11 110.186 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -55.79 148.24 17.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 20.59 111.189 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.7 m -73.87 60.65 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.744 -0.662 . . . . 18.37 112.215 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.96 27.71 1.14 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.305 0.574 . . . . 16.65 110.391 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 78.8 mtp180 -94.21 2.53 55.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.446 -0.797 . . . . 17.53 110.259 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.7 m -54.94 131.2 44.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.7 -0.682 . . . . 15.09 111.886 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.7 m 69.33 66.72 0.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.383 -0.826 . . . . 13.75 111.573 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 7' ' ' ARG . 72.9 mmtt -91.91 -22.92 19.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.821 -0.627 . . . . 14.58 109.687 172.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.84 173.55 6.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.443 -0.799 . . . . 13.16 109.017 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.2 mt -84.07 71.91 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.605 0.717 . . . . 10.1 110.318 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -140.7 143.47 35.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.429 -0.805 . . . . 10.66 109.913 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 m 64.38 11.81 6.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.52 0.676 . . . . 7.42 110.821 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 p -87.79 -7.13 57.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.09 -0.505 . . . . 6.06 111.468 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -70.25 -78.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.827 0.346 . . . . 6.06 110.445 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.4 m -157.93 76.3 0.79 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.417 -0.586 . . . . 2.91 109.417 177.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.0 p 57.8 164.92 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 124.276 0.985 . . . . 1.44 112.643 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.606 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 26.1 m -152.49 146.69 25.46 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.338 0.59 . . . . 1.25 110.428 177.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -80.34 179.5 7.65 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.213 1.006 . . . . 0.39 111.367 -176.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.561 ' O ' HG13 ' A' ' 25' ' ' VAL . 9.7 m-80 -117.12 144.16 45.0 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 106.216 -1.772 . . . . 0.43 106.216 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.95 -15.0 63.41 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 119.437 1.017 . . . . 1.0 111.005 -178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -78.72 -8.0 58.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 108.428 -0.953 . . . . 1.36 108.428 171.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 62' ' ' LEU . 78.2 m-20 -99.02 -49.54 4.48 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.44 -1.255 . . . . 1.27 108.475 174.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 21' ' ' ASN . 1.9 m -89.51 -41.39 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-N 114.768 -1.105 . . . . 1.01 113.133 -166.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.643 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.13 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.593 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 0.2 111.051 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.674 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 0.53 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.593 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.15 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 0.1 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.613 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.11 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 0.17 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.36 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.15 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.475 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 0.66 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.454 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 0.21 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.074 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 0.1 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.749 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 0.09 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 1.95 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.68 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.32 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 63.9 mm-40 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.82 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.519 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.13 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.647 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 1.47 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 0.09 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.25 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.666 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 0.1 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 0.82 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.67 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.14 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.756 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 0.16 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.798 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 0.11 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 1.92 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.756 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 0.14 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.65 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.552 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.27 109.192 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.05 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.69 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.798 ' CE1' HD13 ' A' ' 59' ' ' LEU . 63.5 t60 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.17 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 0.22 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 0.21 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.454 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 0.11 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.35 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 77' ' ' SER . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.18 109.843 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.02 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 0.25 110.826 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.1 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.737 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 0.04 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.07 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.484 HG22 HG22 ' A' ' 119' ' ' THR . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 0.07 110.634 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.758 ' HA ' HG21 ' A' ' 119' ' ' THR . 17.7 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.749 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 0.95 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 0.05 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 0.05 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.553 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 0.05 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.684 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 0.12 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.731 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.704 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 2.94 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.684 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.14 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.903 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.06 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 0.1 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.68 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 0.14 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.074 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 0.15 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.903 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 0.11 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.496 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.837 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 0.2 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 0.9 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 0.2 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.704 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 1.99 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 0.13 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.591 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 0.26 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.29 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.731 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.15 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.22 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.693 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 0.2 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.506 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 0.18 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 1.87 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.16 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 0.26 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.765 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 0.09 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.29 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 0.09 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 0.07 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 1.66 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 0.06 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.09 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.33 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.837 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 0.1 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.802 -0.519 . . . . 22.48 111.802 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 63.66 52.11 2.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.549 0.69 . . . . 23.33 110.354 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -86.17 55.29 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 22.11 110.148 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -140.98 152.06 44.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 20.59 110.073 -174.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.94 -22.36 2.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.688 0.28 . . . . 18.37 111.562 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.95 40.43 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.181 0.515 . . . . 16.65 110.478 -178.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 7' ' ' ARG . 16.2 tpt180 -77.72 -58.44 3.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.948 -0.569 . . . . 17.53 110.674 -178.643 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.2 m 53.61 75.41 0.26 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.639 0.587 . . . . 15.09 110.215 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.1 m -67.26 88.83 0.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.844 -0.616 . . . . 13.75 111.095 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -121.38 111.22 17.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.523 -0.762 . . . . 14.58 109.428 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 45.3 mt-10 -60.18 116.12 3.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.51 -0.314 . . . . 13.16 110.909 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.484 HD12 ' H ' ' A' ' 12' ' ' ILE . 3.9 mp -73.28 110.07 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 109.735 -0.468 . . . . 10.1 109.735 174.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 15.5 mt-10 -124.01 -57.61 1.6 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.589 -0.732 . . . . 10.66 110.309 -175.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -84.01 129.32 34.92 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.425 -0.807 . . . . 7.42 109.569 176.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 p -53.8 119.13 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.376 0.422 . . . . 6.06 110.563 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -78.19 144.16 36.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.607 0.717 . . . . 6.06 112.379 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.9 t -149.57 144.12 26.02 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.707 -1.133 . . . . 2.91 108.158 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 55.6 p 47.79 -92.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.075 0.86 . . . . 1.44 111.933 -178.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.649 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 14.5 m 71.84 150.78 0.1 Allowed 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.484 -1.235 . . . . 1.25 111.978 177.278 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.845 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -91.54 -171.43 2.91 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-N 114.224 -1.353 . . . . 0.39 112.375 -167.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 8.2 m120 -108.55 131.47 54.81 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 105.749 -1.945 . . . . 0.43 105.749 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.61 ' OE1' ' HB ' ' A' ' 25' ' ' VAL . 2.6 mp0 -70.21 -11.39 60.86 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.089 -0.644 . . . . 1.0 109.343 177.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 p -80.09 -8.67 59.51 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 115.141 -0.936 . . . . 1.36 108.677 171.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.653 ' OD2' ' HB2' ' A' ' 61' ' ' LYS . 18.3 t70 -97.08 -59.82 1.71 Allowed 'General case' 0 N--CA 1.416 -2.127 0 CA-C-O 123.225 1.488 . . . . 1.27 110.392 165.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.7 HG22 HD11 ' A' ' 62' ' ' LEU . 54.1 t -61.46 -42.72 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.594 0 CA-C-N 110.918 -2.856 . . . . 1.01 111.134 -156.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.13 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 0.2 110.953 -175.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.701 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 0.53 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.745 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.15 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 0.1 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.759 ' CG ' HD11 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.11 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 0.17 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.36 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.522 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.15 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.745 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.66 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 0.21 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.079 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 0.1 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.716 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 0.09 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 1.95 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.32 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 79.4 mm-40 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.82 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.13 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.633 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 1.47 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.632 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 0.09 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.25 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.711 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 0.1 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 0.82 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.711 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.14 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.645 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 0.16 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.76 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 0.11 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.808 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.653 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 1.92 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.7 HD11 HG22 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 0.14 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.808 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.621 ' HB3' ' C ' ' A' ' 19' ' ' THR . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.27 109.294 178.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.05 110.526 178.13 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.845 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.76 ' CE1' HD13 ' A' ' 59' ' ' LEU . 69.8 t60 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.17 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 0.22 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.805 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 0.21 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.432 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 0.11 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.35 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.18 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.02 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.424 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 0.25 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.595 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.1 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.759 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.69 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.07 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 0.07 110.654 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.718 ' HA ' HG21 ' A' ' 119' ' ' THR . 21.7 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.716 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.69 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 0.95 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 0.05 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 0.05 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.596 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 0.05 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 0.12 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.734 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 2.94 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.14 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.882 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.06 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 0.14 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 1.079 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 0.15 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.882 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 0.11 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.504 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.858 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 0.2 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 0.9 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 0.2 111.477 -175.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.691 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 1.99 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.587 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 0.13 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 0.26 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.29 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.15 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.22 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.714 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 0.2 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.497 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 0.18 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.477 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 1.87 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' HA ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.16 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 0.26 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 0.09 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.29 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 0.09 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 0.07 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 1.66 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 0.06 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.714 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.09 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.33 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.858 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.587 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.58 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 112.908 0.707 . . . . 1.01 112.908 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.58 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.13 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 0.2 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.691 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 0.53 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.688 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.15 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 0.1 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.75 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.654 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.11 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.61 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 0.17 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.36 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.506 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 14.5 m120 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.15 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 0.66 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 0.21 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.856 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 0.1 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 0.09 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.562 ' HG2' HG22 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 1.95 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.682 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.32 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.2 mm100 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.82 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.527 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.13 112.003 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.66 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 1.47 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.666 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 0.09 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.25 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.698 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.58 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 0.1 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 0.82 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.698 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.14 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.766 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 0.16 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.631 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 0.11 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.719 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 1.92 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 0.14 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.719 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.27 109.136 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.05 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 33.1 t-80 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.17 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 0.22 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.786 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 0.21 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.453 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 0.11 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.35 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.18 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.02 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.439 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 0.25 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.72 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.604 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.1 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.75 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 0.04 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.07 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 HG22 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 0.07 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.723 ' HA ' HG21 ' A' ' 119' ' ' THR . 41.3 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 0.06 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 0.95 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 0.05 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 0.05 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 0.05 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 0.12 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 2.94 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.14 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.884 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.06 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 0.1 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.682 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 0.14 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.61 ' C ' HG21 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.856 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 0.15 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.884 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 0.11 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.832 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 0.2 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 0.9 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.65 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 0.2 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 1.99 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.415 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 0.13 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 0.26 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.29 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.15 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.514 ' NZ ' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.22 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.649 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 0.2 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.468 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 0.18 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.468 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 1.87 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.16 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 0.26 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.794 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 0.09 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.29 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 0.09 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 0.07 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.539 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.605 ' HA ' ' HE3' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 1.66 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 0.06 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 128' ' ' LEU . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.09 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.33 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 0.1 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.624 HG22 HD11 ' A' ' 62' ' ' LEU . 77.6 t . . . . . 0 N--CA 1.442 -0.844 0 N-CA-C 112.871 0.693 . . . . 1.01 112.871 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.554 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.13 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 0.2 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 0.53 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.59 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.15 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 0.1 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.638 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.11 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.627 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 0.17 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.454 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 5.6 p-10 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.36 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.454 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.15 108.822 169.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 0.66 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 0.21 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.987 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 0.1 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.745 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 0.09 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.519 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 1.95 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.32 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.5 mm100 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.82 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.538 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.13 111.125 -178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.612 ' HB3' HD21 ' A' ' 31' ' ' LEU . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 1.47 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 0.09 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.25 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.672 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.554 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 0.1 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 0.82 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.672 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.14 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.755 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 0.16 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.625 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 0.11 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 1.92 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 0.14 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.27 109.501 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.05 111.899 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.667 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 36.1 t-80 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.17 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 0.22 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 0.21 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 0.11 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.35 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 77' ' ' SER . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.18 109.771 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.02 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.52 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 0.25 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.716 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.576 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.1 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 0.04 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.07 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.459 HG22 HG22 ' A' ' 119' ' ' THR . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 0.07 110.645 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 37.5 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.745 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 0.06 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.705 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 0.95 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 0.05 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.799 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 0.05 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.589 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.556 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 0.05 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 0.12 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.681 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.744 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.713 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 2.94 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.68 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.14 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.92 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.06 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.799 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 0.1 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 0.14 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.627 ' C ' HG21 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.987 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 0.15 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.92 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 0.11 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.813 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 0.2 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 0.9 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.58 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 0.2 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.713 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 1.99 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 0.13 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.604 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 0.26 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.29 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.15 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.22 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.723 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 0.2 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 0.18 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.815 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 1.87 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.16 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.822 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 0.26 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.75 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 0.09 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.815 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.822 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.29 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 0.09 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 0.07 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.66 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 1.66 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.744 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 0.06 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.723 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.09 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.33 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 0.1 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.581 HG22 HD11 ' A' ' 62' ' ' LEU . 55.4 t . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.624 0.601 . . . . 1.01 112.624 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 55' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.13 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.421 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 0.2 111.178 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.667 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 0.53 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.811 ' HE2' ' HZ3' ' A' ' 41' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.15 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 0.1 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.649 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.11 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.659 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 0.17 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.36 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.811 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 0.66 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.419 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 0.21 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.019 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.1 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.755 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 0.09 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 1.95 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.882 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.32 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.6 mm100 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.82 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.533 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.13 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.635 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 1.47 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 0.09 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.25 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 0.1 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 0.82 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.14 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 0.16 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 0.11 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 1.92 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 0.14 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.27 109.587 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.516 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.05 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.516 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.652 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 35.4 t-80 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.17 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 0.22 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.812 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 0.21 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.443 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 0.11 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.723 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.35 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.18 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.02 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.409 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 0.25 110.933 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.723 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.1 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 0.04 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.07 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 0.07 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.674 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.7 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.755 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 0.06 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 0.95 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 0.05 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 0.05 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.618 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 0.05 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 0.12 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.754 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 2.94 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.14 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.06 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 0.1 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.882 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 0.14 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.659 ' C ' HG21 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.019 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 0.15 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 0.11 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.514 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 0.2 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 0.9 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.626 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 0.2 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 1.99 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.509 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 0.13 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.611 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 0.26 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.29 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.754 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.15 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.22 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 0.2 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.438 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 0.18 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 1.87 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.665 HG21 ' HA ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.16 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.518 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.826 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 0.26 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.789 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 0.09 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.583 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.29 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 0.09 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.789 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 0.07 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.608 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 1.66 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 0.06 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.09 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.33 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 0.1 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.509 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.556 HG21 ' HG3' ' A' ' 67' ' ' GLU . 92.9 t . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 112.407 0.521 . . . . 1.01 112.407 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.617 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.13 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 0.2 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 0.53 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.15 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 0.1 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.617 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.11 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.641 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 0.17 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.36 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.15 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.481 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 0.66 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.447 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 0.21 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.043 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 0.1 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.762 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 0.09 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 1.95 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.7 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.32 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.3 mm100 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.82 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.53 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.13 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.594 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 1.47 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.668 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 0.09 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.25 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 32' ' ' TYR . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 0.1 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 0.82 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.14 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 0.16 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.664 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 0.11 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.667 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 1.92 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.781 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 0.14 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.27 109.061 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.05 111.438 -178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.556 ' HG3' HG21 ' A' ' 25' ' ' VAL . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.677 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 27.7 t-80 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.17 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 0.22 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.764 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 0.21 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 0.11 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.35 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.18 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.764 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.02 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 0.25 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.586 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.1 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.703 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.07 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.472 HG22 HG22 ' A' ' 119' ' ' THR . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 0.07 110.504 178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.774 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.5 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.762 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 0.06 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 0.95 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 0.05 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.804 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 0.05 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.539 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 0.05 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.698 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 0.12 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.722 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.699 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.716 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 2.94 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.698 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.14 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.06 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.804 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 0.1 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.7 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.641 ' C ' HG21 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.043 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 0.15 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 0.11 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 0.2 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . 0.444 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 0.9 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.632 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 0.2 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.716 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 1.99 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.498 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 0.13 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 0.26 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.29 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.722 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.15 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.22 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 0.2 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.45 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 0.18 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 1.87 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.774 HG21 ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.16 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 0.26 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 0.09 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.555 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.29 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 0.09 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 0.07 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.635 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 1.66 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 0.06 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.33 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 0.1 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.498 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.506 HG22 HD11 ' A' ' 62' ' ' LEU . 55.3 t . . . . . 0 N--CA 1.442 -0.87 0 N-CA-C 112.977 0.732 . . . . 1.01 112.977 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.664 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.13 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 0.2 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 0.53 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.586 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.15 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 0.1 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.725 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.604 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.11 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.668 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 0.17 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.36 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.468 ' O ' HG23 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.15 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 0.66 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 0.21 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 0.1 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.712 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 0.09 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 35' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 1.95 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.32 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.675 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.82 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.48 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.13 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.581 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 1.47 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 0.09 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.25 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.718 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 0.1 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.498 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 0.82 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.718 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.14 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.785 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 0.16 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.625 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 0.11 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.815 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 1.92 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 0.14 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.815 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.27 109.037 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.05 112.095 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.66 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 32.9 t-80 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.17 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 0.22 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.771 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 0.21 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.474 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 0.11 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.35 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.18 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.771 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.02 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 0.25 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.1 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.725 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 0.04 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.714 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.07 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.434 HG22 HG22 ' A' ' 119' ' ' THR . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 0.07 110.586 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.733 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.7 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.712 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 0.06 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.714 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 0.95 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.617 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 0.05 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.835 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 0.05 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.617 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 0.05 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 0.12 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.717 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.679 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 2.94 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.14 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.924 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.06 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.835 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 0.1 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 0.14 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.668 ' C ' HG21 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.025 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 0.15 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.924 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 0.11 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.516 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 0.2 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 0.9 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 0.2 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.679 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 1.99 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.52 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 0.13 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 0.26 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.29 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.15 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.22 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 0.2 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 0.18 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 1.87 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.733 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.16 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.837 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 0.26 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.761 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 0.09 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.837 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.29 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 0.09 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 0.07 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.647 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 1.66 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.717 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 0.06 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.674 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.09 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.33 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 0.1 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.52 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.52 HG22 HD11 ' A' ' 62' ' ' LEU . 50.7 t . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 113.041 0.756 . . . . 1.01 113.041 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.648 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.13 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.64 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 0.2 110.91 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 0.53 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.604 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.15 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 0.1 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.11 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 0.17 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.563 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.36 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.563 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.15 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 0.66 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.498 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 0.21 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.085 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 0.1 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 0.09 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 1.95 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.844 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.32 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.544 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.4 mm100 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.82 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.611 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.13 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.65 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 1.47 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 0.09 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.25 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.689 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 0.1 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 0.82 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.14 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.767 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 0.11 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 1.92 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 0.14 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.27 109.288 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.05 111.806 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.507 ' HG3' HG21 ' A' ' 25' ' ' VAL . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.632 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.17 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 0.22 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 0.21 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 0.11 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.35 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.18 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.02 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 0.25 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.607 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.1 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 0.04 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.07 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 119' ' ' THR . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 0.07 110.619 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.728 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 0.06 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 0.95 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 0.05 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.738 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 0.05 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.628 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 0.05 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 0.12 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.684 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 2.94 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.14 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.855 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.06 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.738 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 0.1 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 0.14 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.085 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 0.15 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.855 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 0.11 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.497 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 0.2 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 0.9 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.674 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 0.2 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.684 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 1.99 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 0.26 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.29 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.15 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.22 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.467 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 0.18 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 1.87 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.728 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.16 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.803 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 0.26 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.801 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.732 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 0.09 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.589 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.803 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.29 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 0.09 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 0.07 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.666 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 1.66 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 0.06 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.705 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.09 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.33 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 0.1 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.529 HG22 HD11 ' A' ' 62' ' ' LEU . 66.9 t . . . . . 0 N--CA 1.443 -0.821 0 N-CA-C 113.154 0.798 . . . . 1.01 113.154 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.572 ' CE1' HD13 ' A' ' 55' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.576 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 0.2 111.015 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 0.53 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.725 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.15 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 0.1 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.611 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.11 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.637 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 0.17 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.585 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.36 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.585 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.15 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 0.66 110.532 174.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 0.21 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.008 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 0.1 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.772 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 0.09 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.421 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 1.95 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.32 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.3 mm100 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.82 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.501 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.13 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.58 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 1.47 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 0.09 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.25 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.677 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.572 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 0.1 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 0.82 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.14 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 0.16 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.636 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 0.11 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 1.92 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 0.14 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.27 109.125 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.05 112.191 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.498 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.658 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.2 t-80 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.17 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 0.22 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.809 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 0.21 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 0.11 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.721 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.35 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.18 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.02 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 0.25 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.721 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.1 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.746 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 0.04 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.07 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 0.07 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.787 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.772 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 0.06 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.692 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 0.95 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 0.05 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.764 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 0.05 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.617 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.579 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 0.05 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.716 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 0.12 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 2.94 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.716 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.14 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.88 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.06 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.764 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 0.14 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.637 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.008 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 0.15 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.88 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.503 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.773 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 0.2 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 0.9 109.272 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 0.2 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' HG3' ' A' ' 93' ' ' GLU . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 1.99 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 0.13 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.633 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 0.26 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.29 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.15 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.22 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.7 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 0.2 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 0.18 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 1.87 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.16 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.561 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.814 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 0.26 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.752 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 0.09 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.568 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.814 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.29 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 0.09 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 0.07 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.634 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 1.66 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.706 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 0.06 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.7 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.09 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.33 110.264 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 0.1 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.524 HG22 HD11 ' A' ' 62' ' ' LEU . 54.8 t . . . . . 0 N--CA 1.44 -0.954 0 N-CA-C 113.003 0.742 . . . . 1.01 113.003 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.573 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.13 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 0.2 111.019 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 0.53 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.15 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 0.1 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.11 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.716 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 0.17 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.36 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.15 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 0.66 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.551 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 0.21 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.077 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 0.1 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.725 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 0.09 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 1.95 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.911 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.32 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 8.7 mm100 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.82 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.545 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.13 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 1.47 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 0.09 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.25 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.701 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.573 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 0.1 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 0.82 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.701 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.14 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 0.16 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.628 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 0.11 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.747 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 1.92 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 0.14 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.747 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.27 109.447 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.05 112.017 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.457 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.668 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 31.4 t-80 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.17 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 0.22 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 0.21 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.449 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 0.11 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.644 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.35 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.18 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.02 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.515 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 0.25 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.1 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.727 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 0.04 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.07 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 119' ' ' THR . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 0.07 110.458 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.2 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.725 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 0.06 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.665 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 0.95 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 0.05 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 0.05 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.623 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 0.05 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 0.12 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.717 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.713 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.707 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 2.94 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.14 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.06 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 0.1 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.911 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 0.14 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.716 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.077 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 0.15 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 0.11 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.501 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.835 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 0.2 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 0.9 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.624 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 0.2 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.707 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 1.99 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.567 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 0.13 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.661 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.29 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.717 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.15 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.22 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 0.2 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 0.18 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 1.87 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.778 HG21 ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.16 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 0.26 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.769 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 0.09 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.29 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 0.09 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.769 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 0.07 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 1.66 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.713 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 0.06 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.09 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.33 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.835 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 0.1 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.567 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.6 m . . . . . 0 N--CA 1.439 -1.012 0 N-CA-C 113.476 0.917 . . . . 1.01 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.13 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.642 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 0.53 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.63 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.15 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 0.1 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.585 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.11 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.626 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 0.17 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.36 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.574 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.15 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.63 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 0.66 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.462 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 0.21 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.983 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 0.1 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.754 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 0.09 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HG2' HG22 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 1.95 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.32 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.82 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.13 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 1.47 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 0.09 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.25 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.664 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.639 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 0.1 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.605 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 0.82 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.14 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.771 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 0.16 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.618 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 0.11 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.69 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.686 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 1.92 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 0.14 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.69 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.27 109.55 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.05 111.864 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' OE1' HD12 ' A' ' 70' ' ' LEU . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.17 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 0.22 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.834 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 0.21 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.445 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 0.11 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.35 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.18 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.834 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.02 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.438 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 0.25 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.1 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 0.04 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.07 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.494 HG22 HG22 ' A' ' 119' ' ' THR . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 0.07 110.743 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.766 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.754 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 0.06 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 0.95 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 0.05 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.784 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 0.05 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.632 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.623 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 0.05 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.696 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 0.12 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.72 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.703 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.706 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 2.94 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.696 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.14 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.888 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.06 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.784 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 0.1 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 0.14 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.626 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.983 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 0.15 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.888 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 0.11 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.507 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 0.2 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 0.9 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.64 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 0.2 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.706 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 1.99 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 0.13 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 0.26 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.29 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.72 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.15 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.22 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.485 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 0.18 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 1.87 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.16 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.859 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 0.26 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.797 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.748 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 0.09 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HA ' HD12 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.859 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.29 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 0.09 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 0.07 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.651 ' HB3' HD22 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 1.66 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.703 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 0.06 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.09 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.33 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 0.1 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 112.928 0.714 . . . . 1.01 112.928 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.619 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.629 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 0.2 111.156 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 0.53 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.15 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 0.1 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.627 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.11 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 0.17 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.36 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.15 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 0.66 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.486 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 0.21 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.009 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 0.1 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 0.09 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 1.95 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.4 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.32 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.561 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.82 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.509 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.13 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.62 ' CD ' HD11 ' A' ' 31' ' ' LEU . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 1.47 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.627 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 0.09 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.25 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.619 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 0.1 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 0.82 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.7 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.14 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 0.16 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.62 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 0.11 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.772 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 1.92 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.784 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 0.14 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.772 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.27 109.704 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.05 110.246 177.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.698 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 26.8 t-80 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.17 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 0.22 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.819 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 0.21 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 0.11 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.35 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.18 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.819 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.02 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.414 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 0.25 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.1 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.756 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 0.04 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.07 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.437 HG22 HG22 ' A' ' 119' ' ' THR . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 0.07 110.555 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.705 ' HA ' HG21 ' A' ' 119' ' ' THR . 41.7 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 0.06 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 0.95 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 0.05 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.801 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 0.05 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.6 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 0.05 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.721 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 0.12 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.733 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.717 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 2.94 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.721 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.14 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.875 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.06 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.801 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 0.1 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 0.14 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.009 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 0.15 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.875 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 0.11 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.532 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 0.2 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 0.9 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.625 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 0.2 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.717 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 1.99 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 0.13 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 0.26 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.29 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.733 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.15 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.22 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 0.2 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.48 HG21 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 0.18 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 1.87 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.705 HG21 ' HA ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.16 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 0.26 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.766 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 0.09 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.29 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 0.09 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 0.07 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.665 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 1.66 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 0.06 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.688 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.09 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.33 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 0.1 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.557 HG22 HD11 ' A' ' 62' ' ' LEU . 59.1 t . . . . . 0 N--CA 1.439 -1.01 0 N-CA-C 112.776 0.658 . . . . 1.01 112.776 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.671 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.13 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 0.2 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 0.53 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.15 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 0.1 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.662 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.11 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.708 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 0.17 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.57 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.36 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.57 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.15 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.58 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 0.66 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 0.21 109.466 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.033 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 0.1 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.734 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 0.09 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 1.95 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.885 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.32 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.3 mm100 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.82 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.13 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.637 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 1.47 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.664 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 0.09 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.25 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.69 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.537 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 0.1 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 0.82 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.69 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.14 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 0.16 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.639 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 0.11 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.714 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 1.92 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 0.14 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.714 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.27 109.863 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.05 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 66' ' ' ARG . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.681 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 35.7 t-80 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.17 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 0.22 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.794 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 0.21 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.464 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 0.11 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.662 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.35 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 77' ' ' SER . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.18 109.61 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.02 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 0.25 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.1 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 0.04 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.07 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.468 HG22 HG22 ' A' ' 119' ' ' THR . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 0.07 110.523 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.734 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 0.06 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 0.95 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 0.05 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.742 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 0.05 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 0.05 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 86' ' ' GLN . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 0.12 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.712 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.705 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.71 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 2.94 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.14 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.867 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.06 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.742 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 0.1 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.885 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 0.14 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.708 ' C ' HG21 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.033 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 0.15 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.867 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 0.11 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.52 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.765 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 0.2 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 0.9 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.662 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 0.2 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.71 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 1.99 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 0.13 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.629 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 0.26 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.29 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.712 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.15 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.22 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 0.2 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.496 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 0.18 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 1.87 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.704 HG21 ' HA ' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.16 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.535 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.832 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 0.26 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.804 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.794 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 0.09 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.832 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.29 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 0.09 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 0.07 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.686 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 1.66 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 0.06 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.09 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.33 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.765 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 0.1 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.693 HG21 ' HG3' ' A' ' 67' ' ' GLU . 55.5 t . . . . . 0 N--CA 1.422 -1.827 0 CA-C-O 121.217 0.532 . . . . 1.01 110.86 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.13 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.677 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 0.2 110.911 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.687 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 0.53 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.693 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.15 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 0.1 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.659 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.11 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.67 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 0.17 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.36 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.15 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.46 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 0.66 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 0.21 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.046 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 0.1 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 0.09 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 1.95 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.32 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.6 mm100 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.82 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.13 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.642 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 1.47 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 0.09 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.25 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 0.1 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 0.82 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.14 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.721 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 0.16 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.625 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 0.11 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.704 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 1.92 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.721 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 0.14 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.27 109.432 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.05 110.636 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.693 ' HG3' HG21 ' A' ' 25' ' ' VAL . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.669 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 38.7 t-80 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.17 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 0.22 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 0.21 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 0.11 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.35 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.18 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.02 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 0.25 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.1 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 0.04 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.724 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.07 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 0.07 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.745 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.6 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.742 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 0.06 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 0.95 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 0.05 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.793 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 0.05 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.561 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.605 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 0.05 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 0.12 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.696 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 2.94 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.693 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.14 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.06 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.793 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 0.1 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 0.14 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.67 ' C ' HG21 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.046 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 0.15 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 0.11 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.489 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 0.2 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 0.9 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.673 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 0.2 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.705 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 1.99 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 0.13 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.653 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 0.26 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.29 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.696 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.15 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.22 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 0.2 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 0.18 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 1.87 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.745 HG21 ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.16 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 0.26 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 0.09 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.29 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 0.09 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 0.07 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.588 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 1.66 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 0.06 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.33 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 0.1 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.564 HG22 HD11 ' A' ' 62' ' ' LEU . 53.7 t . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 113.251 0.834 . . . . 1.01 113.251 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.543 ' CE1' HD13 ' A' ' 55' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.13 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.592 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 0.2 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 0.53 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.15 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 0.1 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.11 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 0.17 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.36 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.54 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.15 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.64 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 0.66 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.592 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 0.21 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.035 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 0.1 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 0.09 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 1.95 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.32 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.82 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.568 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.13 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 1.47 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.672 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 0.09 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.25 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.693 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.574 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 0.1 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 0.82 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.14 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.76 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 0.16 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 0.11 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 1.92 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 0.14 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.681 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.27 109.056 178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.601 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.05 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 66' ' ' ARG . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.678 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 27.6 t-80 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.17 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 0.22 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 0.21 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.465 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 0.11 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.35 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.18 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.02 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.432 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 0.25 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.729 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.1 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 0.04 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.07 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 0.07 110.544 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.783 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 0.06 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 0.95 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.615 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 0.05 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.748 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 0.05 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.602 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.518 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.615 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 0.05 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 0.12 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.713 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.685 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 2.94 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.14 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.842 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.06 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.748 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 0.1 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 0.14 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.035 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 0.15 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.842 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 0.11 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.819 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 0.2 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 0.9 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.636 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 0.2 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.711 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 1.99 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 0.13 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 0.26 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.29 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.713 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.15 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.22 108.094 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.698 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 0.2 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.5 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 0.18 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 1.87 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.16 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.592 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 0.26 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 0.09 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.579 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.29 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 0.09 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 0.07 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.636 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 1.66 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 0.06 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.09 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.33 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.819 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 0.1 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.608 HG22 HD11 ' A' ' 62' ' ' LEU . 70.3 t . . . . . 0 N--CA 1.44 -0.959 0 N-CA-C 112.65 0.611 . . . . 1.01 112.65 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.627 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.13 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.675 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 0.2 111.015 -176.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.726 HD12 ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 0.53 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.15 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 0.1 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.726 ' CE2' HD12 ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.11 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.691 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 0.17 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.587 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.36 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.587 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.15 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 0.66 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.789 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 0.21 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.105 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 0.1 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.785 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 0.09 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 1.95 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.32 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.1 mm100 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.82 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.571 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.13 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 1.47 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.683 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 0.09 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.25 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.701 HE22 HD23 ' A' ' 31' ' ' LEU . 0.9 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 0.1 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.658 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 0.82 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.671 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.14 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.779 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 0.16 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.604 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 0.11 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.711 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.597 ' HE2' HD23 ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 1.92 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.779 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 0.14 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.27 109.312 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.05 110.784 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.548 ' HG2' HG21 ' A' ' 25' ' ' VAL . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 28.7 t-80 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.17 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 0.22 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.791 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 0.21 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.435 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 0.11 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.35 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.18 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.791 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.02 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.425 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 0.25 110.584 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.1 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.695 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 0.04 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.682 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.07 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 0.07 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.755 ' HA ' HG21 ' A' ' 119' ' ' THR . 44.5 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.785 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 0.06 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.682 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 0.95 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.629 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 0.05 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.781 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 0.05 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.633 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 0.05 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 0.12 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.725 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.692 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 2.94 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.14 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.861 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.06 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.781 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 0.1 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.412 -175.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.691 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.105 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 0.15 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.861 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 0.11 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.827 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 0.2 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 0.9 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 0.2 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.692 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 1.99 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.459 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 0.13 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 0.26 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.29 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.15 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.22 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 0.2 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.509 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 0.18 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 1.87 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.16 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.838 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 0.26 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.789 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 0.09 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.574 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.838 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.29 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 0.09 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 0.07 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.655 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 1.66 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.725 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 0.06 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.09 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.33 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 0.1 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.516 HG22 HD11 ' A' ' 62' ' ' LEU . 53.8 t . . . . . 0 N--CA 1.442 -0.849 0 N-CA-C 113.145 0.795 . . . . 1.01 113.145 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.675 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.13 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.549 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 0.2 110.801 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.673 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 0.53 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.15 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 0.1 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.653 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.11 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 0.17 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.36 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.613 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.15 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 0.66 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.515 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 0.21 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 0.1 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.764 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 0.09 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.539 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 1.95 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.32 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.547 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 11.0 mm100 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.82 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.588 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.13 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 1.47 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 0.09 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.25 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.686 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 0.1 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.598 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 0.82 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.14 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.16 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 0.11 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.693 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 1.92 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.727 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 0.14 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.27 110.113 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.05 110.268 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.459 ' HG3' HG21 ' A' ' 25' ' ' VAL . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.639 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.0 t-80 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.17 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 0.22 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 0.21 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.441 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 0.11 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.35 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.18 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.02 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 0.25 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.584 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.1 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 0.04 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.07 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.453 HG22 HG22 ' A' ' 119' ' ' THR . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 0.07 110.622 179.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.78 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.764 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 0.06 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 0.95 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 0.05 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 0.05 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.64 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.604 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 0.05 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.7 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 0.12 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.686 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 2.94 107.334 173.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.14 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.849 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.06 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 0.1 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 0.14 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 0.15 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.849 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 0.11 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.806 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 0.2 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 0.9 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.642 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 0.2 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 1.99 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 0.13 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.636 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.29 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.686 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.15 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.22 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.703 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 0.2 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 0.18 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 1.87 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.16 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.794 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 0.26 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 0.09 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.29 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.8 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 0.09 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 0.07 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.65 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 1.66 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.691 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 0.06 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.703 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.09 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.33 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 0.1 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.7 m . . . . . 0 N--CA 1.44 -0.97 0 N-CA-C 113.54 0.941 . . . . 1.01 113.54 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.649 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.13 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.591 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 0.2 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.686 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 0.53 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.708 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.15 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 0.1 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.603 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.11 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.689 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 0.17 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.36 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.15 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.484 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 0.66 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.483 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 0.21 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.013 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 0.1 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 0.09 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 1.95 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.32 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 15.1 mm100 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.82 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.472 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.13 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.591 ' HD2' HD11 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 1.47 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 0.09 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.25 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.528 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 0.1 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.617 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 0.82 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.14 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 0.16 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.643 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 0.11 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.672 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 1.92 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 0.14 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.27 109.582 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.05 112.348 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.637 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 31.8 t-80 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.17 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 0.22 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 0.21 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.442 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 0.11 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.35 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.18 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.02 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 0.25 110.776 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.1 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 0.04 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.688 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.07 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 119' ' ' THR . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 0.07 110.6 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.693 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.0 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 0.06 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 0.95 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.622 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 0.05 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 0.05 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.624 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 0.05 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 0.12 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.718 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.695 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 2.94 109.17 169.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.14 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.06 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 0.1 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 0.14 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.689 ' C ' HG21 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.013 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 0.15 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 0.11 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.51 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.811 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 0.2 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 0.9 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.583 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 0.2 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.695 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 1.99 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.531 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 0.13 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.632 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 0.26 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.29 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.15 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.22 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.681 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 0.2 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.435 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 0.18 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.443 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 1.87 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.16 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 0.26 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.815 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 0.09 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.29 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 0.09 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 0.07 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.6 ' HB3' HD22 ' A' ' 102' ' ' LEU . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 1.66 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 0.06 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.681 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.09 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.33 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 0.1 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.531 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.505 HG22 HD11 ' A' ' 62' ' ' LEU . 42.6 t . . . . . 0 N--CA 1.437 -1.094 0 N-CA-C 112.491 0.552 . . . . 1.01 112.491 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.13 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 0.2 111.186 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 0.53 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.15 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 0.1 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.731 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.635 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.11 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.69 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 0.17 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.36 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.15 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 0.66 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.62 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 0.21 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.076 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 0.1 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 0.09 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.56 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 1.95 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.654 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.32 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.487 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 10.2 mm100 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.82 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.52 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.13 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.604 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 1.47 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 0.09 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.25 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.678 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 0.1 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 0.82 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.696 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.14 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 0.16 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.629 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 0.11 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.696 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 1.92 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 0.14 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.27 109.905 177.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.05 110.154 176.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' OE1' HD12 ' A' ' 70' ' ' LEU . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.649 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.6 t-80 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.17 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 0.22 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.74 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 0.21 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 0.11 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.35 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.18 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.74 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.02 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 0.25 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.1 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.731 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 0.04 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.07 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG22 ' A' ' 119' ' ' THR . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 0.07 110.808 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.72 ' HA ' HG21 ' A' ' 119' ' ' THR . 37.3 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 0.06 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 0.95 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.616 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 0.05 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 0.05 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.646 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.545 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 0.05 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 0.12 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.708 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 2.94 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.14 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.874 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.06 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.78 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 0.1 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.654 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 0.14 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.69 ' C ' HG21 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.076 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 0.15 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.874 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.489 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.86 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 0.2 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 0.9 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 0.2 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.678 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 1.99 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 0.13 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 0.26 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.29 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.15 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.22 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 0.2 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.473 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 0.18 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.402 ' HA ' ' CG ' ' A' ' 125' ' ' ASP . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 1.87 109.869 169.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.72 HG21 ' HA ' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.16 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.62 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.862 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 0.26 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.791 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 0.09 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.862 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.29 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 0.09 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 0.07 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.623 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 1.66 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.708 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 0.06 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.695 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.09 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.33 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.86 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 0.1 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.525 HG22 HD11 ' A' ' 62' ' ' LEU . 55.8 t . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 112.994 0.739 . . . . 1.01 112.994 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.13 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.419 ' ND2' HG13 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.166 -174.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.671 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 0.53 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.767 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.15 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 0.1 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.586 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.11 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 0.17 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.36 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.15 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.709 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 0.66 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.754 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 0.21 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.137 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 0.1 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.751 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 0.09 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.523 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 1.95 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.32 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.522 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.9 mm100 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.82 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.555 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.13 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.625 ' HB3' HD21 ' A' ' 31' ' ' LEU . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 1.47 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.662 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 0.09 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.25 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 0.1 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.625 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 0.82 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.14 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.747 ' O ' HD22 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 0.16 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.624 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 0.11 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.71 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 1.92 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 0.14 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.27 109.796 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.05 111.443 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' HG3' HG21 ' A' ' 25' ' ' VAL . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.673 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.8 t-80 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.17 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 0.22 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 0.21 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.555 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 0.11 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.35 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.18 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.02 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.544 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 0.25 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.1 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 0.04 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.07 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.446 HG22 HG22 ' A' ' 119' ' ' THR . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 0.07 110.586 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.1 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.751 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 0.06 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 0.95 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 0.05 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.817 HG23 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 0.05 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.58 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.05 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 0.12 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.719 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.686 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 2.94 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.14 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.893 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.06 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.817 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 0.1 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 0.14 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.137 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 0.15 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.893 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 0.11 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.506 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.831 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 0.2 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 0.9 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.651 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 0.2 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.686 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 1.99 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.517 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 0.13 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 0.26 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.29 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.719 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.15 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.22 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 0.2 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.47 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 0.18 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HA ' ' OD1' ' A' ' 125' ' ' ASP . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 1.87 109.609 169.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.16 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.88 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 0.26 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.754 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.742 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 0.09 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.88 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.29 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 0.09 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 0.07 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 1.66 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.716 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 0.06 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.09 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.33 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.831 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 0.1 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' A' ' 28' ' ' PHE . 1.9 m . . . . . 0 N--CA 1.439 -1.009 0 N-CA-C 113.133 0.79 . . . . 1.01 113.133 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.643 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.13 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.593 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 0.2 111.051 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.674 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 0.53 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.593 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.15 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 0.1 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.613 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.11 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 0.17 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.36 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.15 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.475 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 0.66 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.454 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 0.21 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.074 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 0.1 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.749 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 0.09 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 1.95 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.68 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.32 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.9 mm100 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.82 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.519 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.13 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.647 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 1.47 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 0.09 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.25 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.666 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 0.1 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 0.82 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.67 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.14 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.756 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 0.16 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.637 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 0.11 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 1.92 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.756 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 0.14 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.65 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.27 109.192 -177.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.05 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.544 ' OE1' HD12 ' A' ' 70' ' ' LEU . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 26.2 t-80 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.17 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 0.22 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 0.21 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.454 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 0.11 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.35 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 77' ' ' SER . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.18 109.843 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.02 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 0.25 110.826 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.1 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.737 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 0.04 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.07 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.484 HG22 HG22 ' A' ' 119' ' ' THR . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 0.07 110.634 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.758 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.3 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.749 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 0.95 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 0.05 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 0.05 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.553 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 0.05 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.684 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 0.12 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.731 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.704 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 2.94 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.684 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.14 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.903 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.06 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 0.1 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.68 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 0.14 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.074 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 0.15 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.903 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 0.11 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.496 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.837 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 0.2 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 0.9 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 0.2 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.704 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 1.99 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 0.13 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.591 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 0.26 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.29 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.731 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.15 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.22 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.693 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 0.2 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.506 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 0.18 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 1.87 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.16 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 0.26 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.765 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 0.09 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.29 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 0.09 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 0.07 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 1.66 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 0.06 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.09 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.33 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.837 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 0.1 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.7 HG22 HD11 ' A' ' 62' ' ' LEU . 54.1 t . . . . . 0 N--CA 1.427 -1.594 0 CA-C-O 121.507 0.67 . . . . 1.01 111.134 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.13 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 0.2 110.953 -175.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.701 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 0.53 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.745 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.15 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 0.1 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.759 ' CG ' HD11 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.11 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 0.17 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.36 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.522 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.15 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.745 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.66 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 0.21 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.079 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 0.1 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.716 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 0.09 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 1.95 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.32 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.7 mm100 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.82 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.13 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.633 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 1.47 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.632 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 0.09 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.25 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.711 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 0.1 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 0.82 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.711 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.14 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.645 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 0.16 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.586 ' O ' ' HD2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 0.11 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.808 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.629 ' HG3' ' O ' ' A' ' 57' ' ' THR . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 1.92 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.7 HD11 HG22 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 0.14 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.808 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.27 109.294 178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.05 110.526 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.685 ' HG3' HG21 ' A' ' 25' ' ' VAL . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.695 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.9 t-80 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.17 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 0.22 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.805 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 0.21 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.432 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 0.11 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.35 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.18 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.02 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.424 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 0.25 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.595 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.1 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.759 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.69 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.07 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 0.07 110.654 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.718 ' HA ' HG21 ' A' ' 119' ' ' THR . 48.5 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.716 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.69 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 0.95 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 0.05 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 0.05 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.596 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 0.05 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 0.12 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.734 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 2.94 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.14 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.882 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.06 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 0.14 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 1.079 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 0.15 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.882 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 0.11 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.504 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . 0.858 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 0.2 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 0.9 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 0.2 111.477 -175.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.691 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 1.99 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.587 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 0.13 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 0.26 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.29 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.15 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.22 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.714 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 0.2 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.497 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 0.18 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.477 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 1.87 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' HA ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.16 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 0.26 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 0.09 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.29 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 0.09 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 0.07 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 1.66 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 0.06 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.714 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.09 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.33 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.858 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . 0.587 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.936 -0.466 . . . . 22.48 111.936 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -100.48 -7.59 24.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.848 0.356 . . . . 23.33 110.687 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 58.8 ttp -76.59 -52.32 9.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 22.11 110.096 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 60.82 81.33 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.843 0.714 . . . . 20.59 111.697 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.9 m -105.15 151.6 7.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.926 -0.579 . . . . 18.37 109.907 175.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -156.06 -163.85 1.57 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.508 -0.314 . . . . 16.65 110.617 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -4.29 45.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.73 -0.214 . . . . 17.53 111.195 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -53.97 -55.53 26.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.234 -0.439 . . . . 15.09 111.159 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.4 m -116.51 52.79 0.91 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.634 0.731 . . . . 13.75 110.23 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -140.01 50.11 1.74 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.638 -0.875 . . . . 14.58 108.638 176.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 68.79 173.32 0.29 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 114.488 -1.233 . . . . 13.16 110.93 -176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.8 mt -88.6 83.49 2.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.93 -0.577 . . . . 10.1 109.852 178.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.44 -173.61 3.73 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.885 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 m 72.16 163.23 0.27 Allowed 'General case' 0 CA--C 1.536 0.421 0 O-C-N 123.784 0.677 . . . . 7.42 110.475 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m 69.24 16.68 8.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.609 0.719 . . . . 6.06 110.188 -177.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -140.6 54.17 1.6 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.34 -0.985 . . . . 6.06 108.34 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.2 m 64.75 -172.51 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.822 -1.081 . . . . 2.91 110.178 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -71.36 148.37 47.08 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.915 0.388 . . . . 1.44 111.187 178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.503 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 38.3 m -142.87 146.53 34.19 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.294 0.568 . . . . 1.25 110.821 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.753 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -77.52 -174.22 3.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 122.329 1.062 . . . . 0.39 112.104 -175.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.3 m-80 -129.83 158.2 40.11 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.323 -1.762 . . . . 0.43 107.041 -173.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.554 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -78.9 -15.53 58.21 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.816 0.735 . . . . 1.0 111.2 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.6 t -80.25 -10.27 59.75 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 107.782 -1.192 . . . . 1.36 107.782 171.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.672 ' HB3' HD13 ' A' ' 62' ' ' LEU . 86.9 m-20 -98.53 -44.43 6.48 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.199 -1.364 . . . . 1.27 109.617 175.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.58 HG22 HD11 ' A' ' 62' ' ' LEU . 78.7 t -90.87 -54.47 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 114.031 -1.441 . . . . 1.01 112.908 -167.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.0 -52.87 59.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.057 -0.52 . . . . 0.51 111.605 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -64.88 -38.95 92.67 Favored 'General case' 0 CA--C 1.503 -0.842 0 N-CA-C 109.985 -0.376 . . . . 0.45 109.985 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.58 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.2 t80 -53.19 -63.44 1.15 Allowed 'General case' 0 CA--C 1.497 -1.083 0 N-CA-C 107.998 -1.112 . . . . 0.13 107.998 174.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 8.1 m-80 -59.25 -27.77 66.1 Favored 'General case' 0 CA--C 1.497 -1.086 0 CA-C-N 113.529 -1.669 . . . . 0.3 111.554 -175.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.1 m -79.11 -48.31 14.55 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.4 -0.818 . . . . 0.2 110.713 -175.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.691 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.8 tp -68.89 -32.11 71.53 Favored 'General case' 0 N--CA 1.434 -1.27 0 N-CA-C 107.244 -1.391 . . . . 0.53 107.244 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.688 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 38.8 t80 -64.14 -47.97 77.85 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 112.979 -1.919 . . . . 0.15 110.764 175.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -25.29 68.07 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.415 1.102 . . . . 0.52 108.703 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.68 -33.68 60.39 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 112.766 -2.015 . . . . 0.1 111.371 -174.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.75 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.9 m-85 -61.81 -21.77 64.9 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 109.138 -0.69 . . . . 0.08 109.138 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.654 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.4 m-85 -94.94 128.84 42.03 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.561 -1.199 . . . . 0.11 109.507 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.61 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.2 p -65.19 -22.82 66.95 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.546 -1.661 . . . . 0.17 110.294 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.9 p-10 -141.45 155.47 45.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.298 -0.864 . . . . 1.52 108.997 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.45 -6.45 51.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.877 0.325 . . . . 0.36 111.877 -175.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.506 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 14.5 m120 -71.16 -16.98 62.56 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.11 -0.7 . . . . 1.15 109.11 168.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.5 mtpt 55.95 44.6 25.4 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-O 122.743 1.259 . . . . 0.66 110.182 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.4 p -112.33 5.53 18.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 112.49 -2.141 . . . . 0.21 109.622 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.856 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.47 145.5 19.04 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.338 -1.301 . . . . 0.1 109.178 -175.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.52 136.91 53.83 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 114.857 1.428 . . . . 0.09 114.857 -172.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.562 ' HG2' HG22 ' A' ' 37' ' ' THR . 33.9 mmtt -83.47 137.37 33.92 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 113.183 -1.826 . . . . 1.95 108.577 175.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.682 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.6 m120 -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.283 -2.291 0 CA-C-N 114.972 -1.013 . . . . 1.78 112.023 -172.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.7 p -63.56 -24.75 67.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.372 0.606 . . . . 1.32 110.7 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.564 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.2 mm100 -76.49 -24.33 53.79 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.637 -0.711 . . . . 0.82 111.868 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.527 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -55.16 -27.33 44.83 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.003 0.372 . . . . 0.13 112.003 -175.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -69.82 -22.77 63.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.752 0.787 . . . . 0.41 109.333 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mttm -95.68 7.89 44.99 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 114.529 -1.214 . . . . 1.47 110.68 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.666 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.02 -37.02 84.83 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 119.924 -0.71 . . . . 0.09 110.76 178.462 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.4 t -69.51 -22.47 63.59 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.921 -0.77 . . . . 1.25 108.921 171.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.698 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -78.26 -38.57 42.43 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.165 -0.925 . . . . 1.24 110.234 175.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.58 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.46 -28.45 68.6 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.378 -0.971 . . . . 0.1 108.378 174.409 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.4 tptp -77.13 -27.08 53.83 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.253 -1.34 . . . . 0.82 108.739 173.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.698 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.71 -40.49 55.59 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 114.198 -1.364 . . . . 0.14 109.923 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.766 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.0 mt -72.01 -39.1 69.43 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 115.46 -0.791 . . . . 0.16 110.146 176.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.631 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -62.36 -37.47 85.81 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.951 -0.759 . . . . 0.11 108.951 169.21 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.719 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -63.7 -20.68 65.91 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.548 0.689 . . . . 0.66 110.299 172.636 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.655 ' HG3' ' O ' ' A' ' 57' ' ' THR . 6.8 mtpm? -81.88 -19.83 40.11 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-O 121.938 0.875 . . . . 1.92 109.777 174.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.48 -22.92 24.62 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.256 -1.338 . . . . 0.14 107.779 177.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.719 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.86 131.78 9.29 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 113.355 -1.748 . . . . 1.75 112.832 175.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.65 -14.2 58.82 Favored Glycine 0 N--CA 1.434 -1.488 0 C-N-CA 120.442 -0.885 . . . . 0.26 111.711 -177.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.493 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.3 m -108.77 165.18 11.75 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.136 -0.69 . . . . 0.27 109.136 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.503 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 26.0 ptt180 -70.21 -31.61 69.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.07 0.462 . . . . 3.05 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.753 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.5 mp0 -57.25 -35.29 69.53 Favored 'General case' 0 CA--C 1.489 -1.398 0 CA-C-N 115.391 -0.822 . . . . 2.51 110.743 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.664 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 33.1 t-80 -42.19 -44.99 3.94 Favored 'General case' 0 C--O 1.191 -1.992 0 CA-C-N 113.694 -1.594 . . . . 0.17 112.237 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -56.65 -53.91 52.16 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 122.877 1.323 . . . . 0.22 111.046 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.786 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.26 -44.19 88.88 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-N 111.905 -2.407 . . . . 0.21 107.475 -174.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.453 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.93 -21.53 37.23 Favored 'General case' 0 N--CA 1.406 -2.628 0 CA-C-N 111.9 -2.409 . . . . 0.11 111.026 -172.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.72 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 21.9 tttp -76.77 -34.54 58.0 Favored 'General case' 0 N--CA 1.42 -1.935 0 N-CA-C 106.195 -1.78 . . . . 1.35 106.195 171.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 13.3 t -75.39 -16.8 60.33 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 113.87 -1.514 . . . . 1.18 109.595 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 11.0 mtpp -85.06 -55.48 4.03 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.187 0.994 . . . . 1.02 109.715 169.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.439 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 16.9 t80 -52.11 -55.96 17.53 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.062 -1.881 . . . . 0.25 111.136 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.72 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.44 -30.37 70.71 Favored 'General case' 0 CA--C 1.503 -0.862 0 CA-C-O 122.568 1.175 . . . . 0.65 107.966 -169.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.604 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -65.99 -56.49 11.39 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 112.622 -2.081 . . . . 0.1 108.324 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.75 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.97 -37.38 87.46 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 113.224 -1.807 . . . . 0.04 109.329 -175.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.712 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.7 -34.14 77.21 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-N 113.355 -1.748 . . . . 0.07 110.313 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 HG22 ' A' ' 119' ' ' THR . 41.9 m -76.09 -36.86 58.75 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 115.528 -0.76 . . . . 0.07 110.607 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.723 ' HA ' HG21 ' A' ' 119' ' ' THR . 41.3 mt-30 -67.04 -40.55 87.19 Favored 'General case' 0 N--CA 1.41 -2.433 0 N-CA-C 109.322 -0.622 . . . . 0.09 109.322 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -47.85 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.935 -1.506 . . . . 0.06 109.449 174.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.712 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.6 mptt -52.25 -33.12 40.24 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 112.541 0.571 . . . . 0.95 112.541 178.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.94 -49.59 69.76 Favored 'General case' 0 CA--C 1.479 -1.777 0 CA-C-N 115.257 -0.883 . . . . 0.05 110.066 173.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.791 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -58.58 -44.66 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 113.593 -1.64 . . . . 0.05 108.217 178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.4 -51.52 69.54 Favored 'General case' 0 N--CA 1.409 -2.495 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.235 178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.5 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.57 -56.0 9.59 Favored 'General case' 0 CA--C 1.491 -1.305 0 O-C-N 124.777 1.298 . . . . 0.4 110.261 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.03 -39.97 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 115.153 -0.931 . . . . 0.05 110.252 -173.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.67 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.3 m-20 -58.24 -30.85 66.85 Favored 'General case' 0 CA--C 1.503 -0.85 0 CA-C-O 122.042 0.925 . . . . 0.09 110.002 172.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -71.98 -13.43 61.62 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.297 -1.774 . . . . 0.12 109.667 -176.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.3 mm-40 -89.74 -18.19 26.82 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 113.923 -1.489 . . . . 0.25 109.398 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.0 m-85 -99.23 157.79 16.14 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 122.024 0.916 . . . . 0.12 111.821 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.682 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.4 mt-10 -65.32 -23.92 67.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 113.359 -1.746 . . . . 0.45 109.316 176.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -143.58 142.28 20.63 Favored Pre-proline 0 CA--C 1.509 -0.611 0 CA-C-N 114.304 -1.316 . . . . 2.94 108.101 173.005 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.67 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 99.4 Cg_exo -49.83 136.84 35.53 Favored 'Trans proline' 0 CA--C 1.487 -1.846 0 C-N-CA 123.915 3.077 . . . . 0.14 112.605 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.884 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.47 53.13 1.97 Allowed 'General case' 0 N--CA 1.409 -2.485 0 C-N-CA 116.754 -1.978 . . . . 0.06 111.533 174.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.791 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.76 98.82 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.932 0 N-CA-C 104.652 -2.351 . . . . 0.1 104.652 149.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.682 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -130.5 113.61 25.92 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.949 0 C-N-CA 119.015 -1.074 . . . . 0.14 109.766 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.61 ' C ' HG21 ' A' ' 37' ' ' THR . 1.2 t0 74.6 40.94 0.37 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.975 -1.466 . . . . 0.53 109.256 -174.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.856 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 73.54 0.15 52.55 Favored Glycine 0 CA--C 1.505 -0.571 0 CA-C-N 115.899 -0.591 . . . . 0.1 113.424 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.03 136.47 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.551 1.167 . . . . 0.15 110.66 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.884 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.68 151.25 47.57 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 113.194 -1.821 . . . . 0.11 112.098 -177.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -102.98 93.97 5.31 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.711 -1.586 . . . . 0.48 107.369 176.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.832 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.67 -10.53 58.63 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 122.67 1.224 . . . . 0.2 109.521 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -84.17 -4.87 59.09 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.605 -2.089 . . . . 0.9 109.321 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.65 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.02 175.97 6.19 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.768 -1.56 . . . . 0.2 111.646 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.682 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -135.72 95.19 3.19 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 113.87 -1.514 . . . . 1.99 111.32 -169.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.415 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.38 100.56 0.36 Allowed 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.244 -0.65 . . . . 0.13 109.244 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.8 mtmt -46.64 167.67 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 114.46 -1.245 . . . . 0.26 113.58 -177.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.6 m -73.75 0.05 14.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.164 -0.926 . . . . 0.29 109.899 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -111.57 -17.82 12.96 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.232 -1.349 . . . . 1.51 108.466 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.67 116.7 1.55 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 122.649 1.214 . . . . 0.15 112.232 176.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.514 ' NZ ' ' HB3' ' A' ' 113' ' ' LYS . 1.1 ttpm? -136.31 98.83 3.94 Favored 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 112.58 -2.1 . . . . 2.22 108.536 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.649 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.99 153.12 20.83 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 113.92 1.082 . . . . 0.15 113.92 -168.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.95 136.78 51.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 113.064 -1.88 . . . . 0.2 108.541 176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.16 71.86 0.27 Allowed 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.968 0.89 . . . . 1.36 108.88 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.468 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.5 mt -74.97 118.37 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 113.803 -1.544 . . . . 0.18 112.6 -172.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.468 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 19.7 mmtp -103.98 118.5 36.83 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-O 122.667 1.222 . . . . 1.87 110.405 167.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 81' ' ' GLN . 82.4 p -91.47 -10.28 41.46 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 112.714 -2.039 . . . . 0.16 108.88 177.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.9 -18.0 56.83 Favored Glycine 0 N--CA 1.428 -1.879 0 CA-C-N 113.932 -1.486 . . . . 0.18 110.733 -168.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.522 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 58.9 t-20 -90.36 107.19 19.0 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.851 -1.166 . . . . 0.45 107.851 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 51.5 m -66.37 -56.88 8.97 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 112.272 0.471 . . . . 0.26 112.272 -174.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.794 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.07 -32.7 55.47 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 110.006 -0.368 . . . . 1.66 110.006 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.786 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.1 tp -71.33 -46.33 60.84 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 115.797 -0.638 . . . . 0.09 109.483 175.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 5.7 t70 -49.04 -42.64 39.09 Favored 'General case' 0 CA--C 1.496 -1.109 0 CA-C-O 122.407 1.099 . . . . 1.49 108.818 175.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.1 mtpt -74.46 -17.72 60.74 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 113.12 -1.855 . . . . 1.29 112.642 -177.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 123' ' ' GLU . 39.6 t -96.9 -30.06 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 CA-C-O 121.666 0.746 . . . . 0.09 109.232 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -56.07 -48.96 75.09 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 106.161 -1.792 . . . . 0.07 106.161 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.539 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -57.21 -47.09 82.17 Favored 'General case' 0 CA--C 1.492 -1.27 0 CA-C-N 110.739 -2.937 . . . . 0.37 111.403 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.605 ' HE3' ' HA ' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -44.51 -46.2 9.67 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 112.131 -2.304 . . . . 1.66 109.858 178.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.25 -51.61 35.82 Favored 'General case' 0 C--N 1.296 -1.756 0 CA-C-N 113.535 -1.666 . . . . 0.06 109.683 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 128' ' ' LEU . 1.9 mt -52.32 -23.95 5.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.104 -0.953 . . . . 0.09 111.662 176.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 36.1 m -82.23 -15.22 53.87 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.286 -0.87 . . . . 1.33 110.194 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.832 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.32 -27.58 38.36 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.746 -1.115 . . . . 0.1 108.568 167.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.842 -0.976 . . . . 1.19 112.618 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.837 -0.505 . . . . 22.48 111.837 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -133.51 76.59 1.68 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.243 0.544 . . . . 23.33 110.415 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 42.9 ttm -88.59 -48.11 7.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.582 -0.735 . . . . 22.11 110.075 177.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -93.85 64.08 3.38 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.364 -0.835 . . . . 20.59 110.566 -175.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.5 -38.5 46.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.318 0.58 . . . . 18.37 109.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -114.9 113.55 24.32 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.622 -0.717 . . . . 16.65 110.057 176.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 8' ' ' SER . 3.7 ppt_? -68.43 -18.46 64.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 17.53 111.064 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.435 ' N ' ' HD2' ' A' ' 7' ' ' ARG . 52.4 p -165.01 -52.36 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 15.09 110.052 173.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 t -170.74 145.59 2.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.041 -0.527 . . . . 13.75 111.244 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -146.03 10.79 1.18 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.526 0.679 . . . . 14.58 109.324 172.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.61 ' HG2' ' H ' ' A' ' 12' ' ' ILE . 30.8 tt0 -137.12 -173.92 3.6 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.479 -0.934 . . . . 13.16 108.479 -175.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.61 ' H ' ' HG2' ' A' ' 11' ' ' GLU . 71.3 mt -68.49 86.33 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.311 0.577 . . . . 10.1 109.687 171.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -135.51 -14.2 1.96 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.64 -0.709 . . . . 10.66 110.436 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.4 t -128.22 23.98 5.97 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.542 -0.754 . . . . 7.42 110.166 -175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 12.8 p -67.04 123.09 19.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.459 -0.791 . . . . 6.06 109.869 177.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.473 ' HB3' ' O ' ' A' ' 15' ' ' SER . 6.7 tt0 70.68 -67.3 0.25 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.615 0.572 . . . . 6.06 110.442 -175.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.4 m -128.35 168.83 14.99 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 2.91 110.103 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 82.2 p -77.02 -160.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.988 -0.551 . . . . 1.44 110.907 -179.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.593 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 33.1 m -117.15 140.91 48.94 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.358 -0.608 . . . . 1.25 109.358 167.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -71.41 172.97 8.5 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 122.541 1.162 . . . . 0.39 112.359 -172.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.484 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.8 m-80 -115.28 153.23 31.3 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 112.728 -2.033 . . . . 0.43 107.59 -173.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.57 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -77.7 -10.5 59.56 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.076 -0.65 . . . . 1.0 110.914 -177.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 p -83.82 -9.93 58.42 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 108.515 -0.92 . . . . 1.36 108.515 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.618 ' HB3' HD13 ' A' ' 62' ' ' LEU . 82.5 m-20 -98.12 -46.99 5.66 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-N 114.36 -1.291 . . . . 1.27 109.066 174.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.624 HG22 HD11 ' A' ' 62' ' ' LEU . 77.6 t -85.29 -53.93 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 113.667 -1.606 . . . . 1.01 112.871 -165.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 27.1 t70 -53.39 -51.46 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.075 -0.511 . . . . 0.51 111.564 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -64.57 -40.36 95.4 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.812 -0.44 . . . . 0.45 109.812 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.554 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.7 t80 -53.61 -63.88 1.01 Allowed 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 108.142 -1.059 . . . . 0.13 108.142 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -60.93 -28.04 68.65 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.409 -1.723 . . . . 0.3 111.445 -174.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -78.71 -46.97 17.82 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.573 -0.74 . . . . 0.2 110.795 -175.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 14.4 tp -70.25 -31.68 69.18 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 107.34 -1.356 . . . . 0.53 107.34 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.59 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.7 t80 -64.64 -47.22 79.32 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 113.002 -1.908 . . . . 0.15 110.763 176.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -27.9 69.38 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.566 1.174 . . . . 0.52 108.685 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.23 -32.93 67.17 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 112.632 -2.076 . . . . 0.1 111.737 -175.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.8 m-85 -61.83 -21.25 64.48 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-O 121.484 0.659 . . . . 0.08 109.307 176.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.638 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.0 m-85 -94.95 127.36 40.94 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-N 114.661 -1.154 . . . . 0.11 109.214 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.627 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.2 p -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 113.522 -1.672 . . . . 0.17 110.737 -178.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.454 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 5.6 p-10 -147.98 152.88 38.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.598 -0.89 . . . . 1.52 108.598 178.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 2.71 5.24 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.602 0.964 . . . . 0.36 113.602 -167.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.454 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 90.8 m-20 -75.3 -17.29 60.31 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 108.822 -0.807 . . . . 1.15 108.822 169.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 56.99 41.68 27.3 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.404 -1.271 . . . . 0.66 110.574 175.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 40.3 p -108.63 1.71 21.48 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 112.424 -2.171 . . . . 0.21 109.555 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.987 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.65 148.23 23.99 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.214 -1.357 . . . . 0.1 109.259 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.745 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 140.56 52.43 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 114.478 1.288 . . . . 0.09 114.478 -172.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.519 ' HE3' ' OD2' ' A' ' 99' ' ' ASP . 10.3 mmtp -89.8 132.8 35.05 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 113.619 -1.628 . . . . 1.95 109.407 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.7 m120 -83.92 -22.07 31.66 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 114.375 -1.284 . . . . 1.78 112.091 -168.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -69.09 -27.37 65.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.377 0.608 . . . . 1.32 110.131 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 12.5 mm100 -71.61 -23.9 61.79 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.544 -0.753 . . . . 0.82 110.896 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.538 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.6 m-30 -55.83 -25.09 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.37 . . . . 0.13 111.125 -178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.81 -21.27 62.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.185 0.993 . . . . 0.41 109.915 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.612 ' HB3' HD21 ' A' ' 31' ' ' LEU . 3.6 mmtt -100.02 7.11 44.97 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.201 -1.363 . . . . 1.47 110.632 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.39 -40.56 93.6 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 120.307 -0.557 . . . . 0.09 110.927 179.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.9 m -69.07 -17.52 63.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.46 -0.57 . . . . 1.25 109.46 173.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.672 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.4 OUTLIER -83.4 -37.4 23.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.19 -0.914 . . . . 1.24 109.859 175.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.554 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.12 -28.95 69.19 Favored 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 108.089 -1.078 . . . . 0.1 108.089 174.342 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -75.5 -31.18 60.09 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.206 -1.361 . . . . 0.82 108.623 173.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.672 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -71.16 -38.99 72.18 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.619 -1.173 . . . . 0.14 109.959 178.643 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.755 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.4 mt -73.41 -40.12 64.52 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.321 -0.854 . . . . 0.16 110.675 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.625 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.94 -37.42 84.63 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.847 -0.798 . . . . 0.11 108.847 169.101 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.23 -20.09 65.81 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.624 -0.716 . . . . 0.66 110.294 172.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' A' ' 57' ' ' THR . 79.2 mttt -82.65 -19.09 38.92 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.303 -0.862 . . . . 1.92 109.864 173.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.71 -23.19 24.24 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.483 -1.235 . . . . 0.14 107.757 177.175 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.2 mm-40 -45.73 127.28 7.75 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 113.325 -1.761 . . . . 1.75 112.95 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.88 -14.79 64.29 Favored Glycine 0 N--CA 1.434 -1.46 0 CA-C-N 115.252 -0.886 . . . . 0.26 111.258 -177.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.523 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 7.4 m -110.24 159.5 17.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.501 -0.555 . . . . 0.27 109.501 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.602 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.7 ptp180 -66.51 -28.45 68.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.973 0.416 . . . . 3.05 111.899 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.742 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.6 mp0 -59.14 -36.9 76.06 Favored 'General case' 0 CA--C 1.492 -1.261 0 CA-C-N 115.617 -0.72 . . . . 2.51 110.931 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.667 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 36.1 t-80 -40.97 -45.63 2.63 Favored 'General case' 0 C--O 1.193 -1.873 0 CA-C-N 113.783 -1.553 . . . . 0.17 112.629 174.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.2 m -56.27 -54.13 49.0 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 123.095 1.426 . . . . 0.22 111.104 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.74 -43.88 91.92 Favored 'General case' 0 CA--C 1.475 -1.919 0 CA-C-N 111.791 -2.459 . . . . 0.21 107.369 -174.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.45 -20.82 36.19 Favored 'General case' 0 N--CA 1.405 -2.698 0 CA-C-N 111.887 -2.415 . . . . 0.11 110.98 -172.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.7 tttp -76.1 -35.65 59.23 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 106.115 -1.809 . . . . 1.35 106.115 171.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 77' ' ' SER . 32.8 t -75.05 -16.55 60.58 Favored 'General case' 0 N--CA 1.427 -1.586 0 CA-C-N 113.602 -1.635 . . . . 1.18 109.771 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.0 mtpp -86.03 -54.2 4.62 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 122.156 0.979 . . . . 1.02 109.786 169.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.52 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.5 t80 -53.16 -56.97 12.17 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 113.255 -1.793 . . . . 0.25 111.036 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.716 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -65.81 -29.33 69.8 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 122.674 1.226 . . . . 0.65 107.913 -169.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.576 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -68.32 -56.34 8.92 Favored 'General case' 0 N--CA 1.434 -1.273 0 CA-C-N 112.466 -2.152 . . . . 0.1 108.628 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.745 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.23 -37.24 86.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 113.266 -1.788 . . . . 0.04 109.168 -175.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.705 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.59 -32.29 73.54 Favored 'General case' 0 CA--C 1.493 -1.244 0 CA-C-N 113.227 -1.806 . . . . 0.07 110.258 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.459 HG22 HG22 ' A' ' 119' ' ' THR . 50.2 m -77.33 -37.21 52.94 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.491 -0.777 . . . . 0.07 110.645 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 37.5 mt-30 -67.14 -40.06 86.69 Favored 'General case' 0 N--CA 1.412 -2.356 0 N-CA-C 109.142 -0.688 . . . . 0.09 109.142 -177.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.745 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.76 -49.29 30.33 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.362 0 C-N-CA 118.105 -1.438 . . . . 0.06 109.219 174.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.705 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.8 mptt -51.84 -32.56 32.35 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 112.655 0.613 . . . . 0.95 112.655 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.93 -49.2 68.82 Favored 'General case' 0 CA--C 1.478 -1.823 0 CA-C-N 115.126 -0.943 . . . . 0.05 110.023 174.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.799 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.0 mt -59.36 -44.51 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.673 0 CA-C-N 113.663 -1.608 . . . . 0.05 108.131 179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.589 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.87 -51.16 71.19 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 114.013 -1.449 . . . . 0.09 108.371 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.556 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.0 OUTLIER -48.98 -58.3 5.11 Favored 'General case' 0 CA--C 1.492 -1.257 0 O-C-N 125.174 1.547 . . . . 0.4 110.135 -177.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -74.21 -40.65 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.644 0 CA-C-N 114.771 -1.104 . . . . 0.05 110.025 -172.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -57.53 -29.72 64.59 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.912 0.863 . . . . 0.09 109.922 172.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.22 -11.44 60.07 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.648 -1.614 . . . . 0.12 109.862 -175.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.681 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -89.74 -20.56 23.43 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.267 -1.333 . . . . 0.25 109.4 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.744 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 23.4 m-85 -97.03 158.57 15.36 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.935 0.874 . . . . 0.12 111.5 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.713 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 16.3 mt-10 -63.06 -28.22 69.93 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 113.526 -1.67 . . . . 0.45 108.955 175.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 7.0 mmtt -139.85 143.59 35.26 Favored Pre-proline 0 CA--C 1.514 -0.419 0 CA-C-N 114.454 -1.248 . . . . 2.94 107.636 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.68 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.6 Cg_exo -49.85 136.91 35.67 Favored 'Trans proline' 0 CA--C 1.487 -1.834 0 C-N-CA 124.007 3.138 . . . . 0.14 112.471 -176.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.92 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.8 1.95 Allowed 'General case' 0 N--CA 1.409 -2.511 0 C-N-CA 116.661 -2.015 . . . . 0.06 111.462 173.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.799 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.4 99.11 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 N-CA-C 105.039 -2.208 . . . . 0.1 105.039 149.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 30.0 m -132.58 111.11 16.86 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.877 0 C-N-CA 119.175 -1.01 . . . . 0.14 110.063 -176.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.627 ' C ' HG21 ' A' ' 37' ' ' THR . 31.7 t70 76.98 41.4 0.16 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 113.862 -1.517 . . . . 0.53 109.715 -171.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.987 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.86 4.27 33.02 Favored Glycine 0 CA--C 1.504 -0.65 0 CA-C-N 115.412 -0.813 . . . . 0.1 113.082 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.68 135.7 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 CA-C-O 122.665 1.221 . . . . 0.15 110.666 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.92 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.18 152.19 46.19 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.92 -1.946 . . . . 0.11 111.511 -177.778 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.9 OUTLIER -103.5 94.52 5.52 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.973 -1.467 . . . . 0.48 107.431 175.343 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.813 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.6 p -69.41 -10.87 59.89 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.672 1.225 . . . . 0.2 110.028 -176.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -85.25 -6.24 59.27 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 112.822 -1.99 . . . . 0.9 109.488 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.58 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.13 176.03 4.12 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.636 -1.62 . . . . 0.2 111.477 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.713 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 4.1 mmmm -134.03 97.03 3.76 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 113.844 -1.526 . . . . 1.99 111.261 -169.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.33 101.37 0.42 Allowed 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 108.762 -0.829 . . . . 0.13 108.762 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.604 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.9 mtmt -46.03 164.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.661 -1.154 . . . . 0.26 113.07 -177.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.4 m -72.59 0.77 9.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.754 0.788 . . . . 0.29 110.137 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -114.16 -15.86 12.16 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.502 -1.227 . . . . 1.51 108.942 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.681 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.85 116.41 1.34 Allowed 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.636 1.208 . . . . 0.15 111.622 174.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 27.6 tttt -134.96 100.51 4.6 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 112.739 -2.028 . . . . 2.22 107.991 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.723 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.0 m-85 -88.92 154.3 20.34 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.534 1.159 . . . . 0.15 113.63 -167.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.3 p -128.06 132.4 49.05 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.77 -2.014 . . . . 0.2 107.96 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.98 70.84 0.37 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.107 0.956 . . . . 1.36 108.833 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 16.6 mt -71.91 117.94 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.375 0 CA-C-N 113.392 -1.731 . . . . 0.18 111.953 -171.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.815 ' HA ' ' OD2' ' A' ' 125' ' ' ASP . 62.7 mmtt -101.4 113.04 25.77 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.78 1.276 . . . . 1.87 110.364 171.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -85.73 -14.98 43.67 Favored 'General case' 0 C--N 1.288 -2.1 0 CA-C-N 112.35 -2.205 . . . . 0.16 108.804 176.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 91.93 -19.94 45.69 Favored Glycine 0 N--CA 1.429 -1.801 0 CA-C-N 114.167 -1.379 . . . . 0.18 111.398 -168.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.13 103.04 14.41 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 107.471 -1.307 . . . . 0.45 107.471 174.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.822 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 44.1 m -61.46 -57.83 10.61 Favored 'General case' 0 C--O 1.209 -1.052 0 N-CA-C 112.633 0.605 . . . . 0.26 112.633 -174.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.3 mt-10 -54.59 -33.58 60.56 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 110.203 -0.295 . . . . 1.66 110.203 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.75 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.4 tp -72.79 -44.7 61.2 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.874 -0.787 . . . . 0.09 108.874 175.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.815 ' OD2' ' HA ' ' A' ' 118' ' ' LYS . 0.5 OUTLIER -57.07 -32.55 66.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.9 -1.045 . . . . 1.49 109.134 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.822 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.6 mtpp -78.09 -22.28 49.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-N 114.329 -1.305 . . . . 1.29 112.051 177.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -92.75 -30.07 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 108.873 -0.788 . . . . 0.09 108.873 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.2 mt -55.05 -49.08 72.5 Favored 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 106.492 -1.67 . . . . 0.07 106.492 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.9 OUTLIER -59.01 -46.38 88.32 Favored 'General case' 0 CA--C 1.501 -0.932 0 CA-C-N 110.502 -3.045 . . . . 0.37 111.316 -179.239 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.66 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -47.91 -42.44 27.04 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 112.521 -2.127 . . . . 1.66 110.009 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.744 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.16 -53.05 22.09 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.038 -1.437 . . . . 0.06 109.487 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.723 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.29 -23.45 4.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 115.46 -0.791 . . . . 0.09 111.443 175.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.2 p -76.43 -20.16 57.35 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 121.701 0.763 . . . . 1.33 109.301 -178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.813 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -79.67 -26.1 41.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.656 -1.156 . . . . 0.1 108.883 172.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.551 -1.138 . . . . 1.19 112.159 176.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 112.072 -0.411 . . . . 22.48 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -132.84 31.4 3.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.79 0.329 . . . . 23.33 110.685 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt 66.37 107.21 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.396 -0.82 . . . . 22.11 111.999 176.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -98.23 -85.54 0.37 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.071 -0.513 . . . . 20.59 110.161 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.0 m -137.97 158.39 33.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.976 -0.556 . . . . 18.37 109.657 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.95 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.744 0.652 . . . . 16.65 111.116 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -65.46 -20.01 66.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.156 -0.474 . . . . 17.53 111.447 -176.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.8 m 60.98 -159.51 0.32 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.786 -0.643 . . . . 15.09 111.189 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.7 m -89.51 -60.17 2.02 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.906 -0.405 . . . . 13.75 109.906 175.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -164.68 -59.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.962 -0.755 . . . . 14.58 108.962 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -133.02 153.92 51.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 13.16 109.502 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -84.12 85.9 2.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.291 0.567 . . . . 10.1 110.378 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -131.42 -66.01 0.74 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.674 -0.694 . . . . 10.66 109.785 177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.625 HG23 HG23 ' A' ' 18' ' ' THR . 9.8 m -139.8 57.17 1.63 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.724 -1.126 . . . . 7.42 109.29 -176.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.1 m -76.84 -20.3 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.828 -0.624 . . . . 6.06 111.717 -174.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -130.5 39.38 3.63 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.653 0.739 . . . . 6.06 109.866 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m 58.96 -168.61 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.901 -1.045 . . . . 2.91 112.141 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.625 HG23 HG23 ' A' ' 14' ' ' THR . 25.7 p -141.29 159.85 41.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.348 -0.842 . . . . 1.44 110.331 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 30.1 m -145.98 143.18 29.32 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.452 0.644 . . . . 1.25 110.547 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -74.31 174.37 8.92 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.642 -1.163 . . . . 0.39 112.257 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 9.8 m-80 -112.42 150.72 30.75 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.79 -2.004 . . . . 0.43 107.46 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.621 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -76.34 -9.75 58.88 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.76 -178.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 p -82.29 -14.4 55.45 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.483 -0.932 . . . . 1.36 108.483 170.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.621 ' HB3' HD13 ' A' ' 62' ' ' LEU . 80.1 m-20 -93.02 -47.06 7.18 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.324 -1.307 . . . . 1.27 108.765 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.621 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 55.4 t -82.58 -48.62 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.076 -1.875 . . . . 1.01 112.624 -166.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.43 -58.52 7.12 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 0.51 112.271 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.72 -34.77 78.97 Favored 'General case' 0 CA--C 1.499 -1.012 0 N-CA-C 109.786 -0.45 . . . . 0.45 109.786 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' HD13 ' A' ' 55' ' ' LEU . 77.0 t80 -53.51 -63.75 1.05 Allowed 'General case' 0 CA--C 1.496 -1.129 0 N-CA-C 107.755 -1.202 . . . . 0.13 107.755 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.421 ' OD1' ' NZ ' ' A' ' 74' ' ' LYS . 8.4 m-80 -59.73 -33.12 71.23 Favored 'General case' 0 CA--C 1.493 -1.229 0 CA-C-N 113.104 -1.862 . . . . 0.3 111.548 -176.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m -74.1 -49.47 23.78 Favored 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 115.343 -0.844 . . . . 0.2 111.178 -175.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.667 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 11.9 tp -66.77 -34.6 78.18 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 107.22 -1.4 . . . . 0.53 107.22 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.811 ' HE2' ' HZ3' ' A' ' 41' ' ' LYS . 48.9 t80 -62.47 -48.31 80.18 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.26 -1.791 . . . . 0.15 110.683 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -25.89 68.06 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-O 122.478 1.132 . . . . 0.52 108.741 177.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.95 -33.36 59.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 112.706 -2.043 . . . . 0.1 111.273 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.0 m-85 -61.76 -19.95 63.03 Favored 'General case' 0 CA--C 1.489 -1.399 0 N-CA-C 109.253 -0.647 . . . . 0.08 109.253 176.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.649 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 81.9 m-85 -96.96 129.75 44.38 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-N 114.643 -1.162 . . . . 0.11 109.442 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.659 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.9 p -63.98 -20.9 66.23 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 113.638 -1.619 . . . . 0.17 110.451 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -142.3 162.04 36.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.331 -0.85 . . . . 1.52 109.456 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -78.44 -1.68 34.77 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 121.04 -0.264 . . . . 0.36 111.486 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.55 -17.49 60.06 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 170.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.811 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 8.3 mtpt 54.22 40.88 32.1 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 114.166 -1.379 . . . . 0.66 110.716 175.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.419 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 41.2 p -105.35 -3.87 22.19 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 112.744 -2.026 . . . . 0.21 109.581 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.019 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.57 145.9 26.22 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.1 109.225 -173.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.755 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.71 140.03 53.31 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 114.656 1.354 . . . . 0.09 114.656 -172.267 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.492 ' HG2' HG22 ' A' ' 37' ' ' THR . 34.5 mmtt -87.31 135.56 33.27 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.605 -1.634 . . . . 1.95 109.138 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.882 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m120 -87.39 -24.52 24.19 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 114.162 -1.381 . . . . 1.78 112.17 -168.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.7 t -67.62 -27.01 66.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.313 0.578 . . . . 1.32 110.021 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.6 mm100 -71.78 -23.16 61.53 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.903 -0.589 . . . . 0.82 111.674 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.533 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.9 m-30 -55.4 -25.46 35.9 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.148 0.425 . . . . 0.13 112.148 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -72.37 -26.73 62.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.112 0.958 . . . . 0.41 108.84 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.635 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.6 OUTLIER -92.93 9.77 34.08 Favored 'General case' 0 C--O 1.211 -0.948 0 CA-C-N 114.07 -1.423 . . . . 1.47 109.81 -179.057 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.85 -39.33 83.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.443 -0.503 . . . . 0.09 110.095 176.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.5 t -68.34 -21.45 64.74 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.746 -0.835 . . . . 1.25 108.746 172.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.4 tt0 -80.68 -37.34 30.98 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 115.204 -0.907 . . . . 1.24 110.199 175.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.52 -27.52 67.83 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 108.188 -1.042 . . . . 0.1 108.188 174.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -76.11 -33.28 59.46 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 114.1 -1.409 . . . . 0.82 108.46 173.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.671 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.16 -37.07 78.03 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.681 -1.145 . . . . 0.14 110.142 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -74.48 -40.94 61.53 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 115.198 -0.91 . . . . 0.16 110.865 177.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.653 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.48 -36.32 82.11 Favored 'General case' 0 C--N 1.309 -1.195 0 N-CA-C 108.9 -0.778 . . . . 0.11 108.9 168.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.706 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 2.4 m-20 -62.36 -21.71 65.53 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.394 -0.821 . . . . 0.66 110.082 171.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 25.0 mtpp -80.86 -24.88 38.06 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.134 0.968 . . . . 1.92 109.654 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -83.73 -22.27 32.02 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-N 113.909 -1.496 . . . . 0.14 107.575 -179.697 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.706 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 9.6 mt-10 -43.63 132.34 4.92 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 113.353 -1.749 . . . . 1.75 111.734 174.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.26 -7.97 69.6 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.415 -0.897 . . . . 0.26 112.134 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.4 m -111.26 169.56 8.7 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.587 -0.523 . . . . 0.27 109.587 176.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.516 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 21.9 ptt180 -74.7 -31.43 61.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.378 0.609 . . . . 3.05 110.493 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.779 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.3 mp0 -56.09 -37.25 69.09 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 115.019 -0.991 . . . . 2.51 110.31 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.652 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 35.4 t-80 -40.87 -46.17 2.68 Favored 'General case' 0 C--O 1.19 -2.074 0 CA-C-N 113.405 -1.725 . . . . 0.17 112.674 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.4 m -57.93 -53.75 54.68 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 123.115 1.436 . . . . 0.22 110.951 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.812 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.98 -42.83 89.31 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 111.582 -2.553 . . . . 0.21 107.544 -174.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.443 ' HA ' ' CD ' ' A' ' 74' ' ' LYS . . . -84.99 -18.09 35.55 Favored 'General case' 0 N--CA 1.408 -2.55 0 CA-C-N 112.164 -2.289 . . . . 0.11 110.995 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.723 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 20.7 tttp -76.08 -34.43 59.54 Favored 'General case' 0 CA--C 1.475 -1.923 0 N-CA-C 105.995 -1.854 . . . . 1.35 105.995 169.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.512 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.6 t -75.51 -18.23 59.87 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-N 113.36 -1.745 . . . . 1.18 109.609 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.812 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 21.1 mtpt -83.8 -55.39 4.28 Favored 'General case' 0 CA--C 1.488 -1.405 0 CA-C-O 122.19 0.995 . . . . 1.02 109.734 170.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.409 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.3 t80 -52.28 -57.05 10.92 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 112.902 -1.954 . . . . 0.25 110.933 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.723 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -66.62 -29.56 69.63 Favored 'General case' 0 CA--C 1.501 -0.914 0 CA-C-O 122.629 1.204 . . . . 0.65 108.089 -169.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 38.8 t -67.15 -55.85 12.42 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.555 -2.111 . . . . 0.1 108.401 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.9 OUTLIER -65.06 -37.34 87.25 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.166 -1.834 . . . . 0.04 109.175 -175.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.699 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.29 -33.73 76.39 Favored 'General case' 0 CA--C 1.491 -1.29 0 CA-C-N 113.371 -1.74 . . . . 0.07 110.209 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 119' ' ' THR . 45.1 m -76.19 -37.05 58.34 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-N 115.565 -0.743 . . . . 0.07 110.515 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.674 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.7 mt-30 -67.04 -40.04 87.08 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 109.193 -0.669 . . . . 0.09 109.193 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.755 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.1 -47.52 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.321 0 C-N-CA 118.08 -1.448 . . . . 0.06 109.449 174.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.41 -31.41 55.03 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.064 0.459 . . . . 0.95 112.074 179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.624 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.94 -48.74 70.37 Favored 'General case' 0 CA--C 1.478 -1.806 0 CA-C-N 115.076 -0.965 . . . . 0.05 110.035 173.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.65 -43.67 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.627 0 CA-C-N 113.554 -1.657 . . . . 0.05 108.118 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.618 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -60.78 -49.52 77.15 Favored 'General case' 0 N--CA 1.408 -2.566 0 CA-C-N 114.113 -1.403 . . . . 0.09 108.41 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.596 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -49.01 -56.82 7.79 Favored 'General case' 0 CA--C 1.488 -1.41 0 O-C-N 124.973 1.421 . . . . 0.4 110.097 -178.558 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -77.45 -38.95 27.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 CA-C-N 114.996 -1.002 . . . . 0.05 110.431 -172.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.69 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -59.21 -26.37 64.79 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.889 0.852 . . . . 0.09 109.796 171.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.93 -10.5 59.55 Favored 'General case' 0 CA--C 1.503 -0.842 0 CA-C-N 113.88 -1.509 . . . . 0.12 109.733 -177.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.754 ' OE1' ' HA ' ' A' ' 112' ' ' ALA . 49.2 mm-40 -93.49 -17.31 23.56 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 113.984 -1.462 . . . . 0.25 109.854 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -101.82 156.9 17.22 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.995 0.903 . . . . 0.12 111.583 176.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.694 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -63.11 -26.34 68.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 113.325 -1.761 . . . . 0.45 109.168 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 1.7 mtpt -143.87 142.94 21.37 Favored Pre-proline 0 CA--C 1.514 -0.436 0 N-CA-C 107.487 -1.301 . . . . 2.94 107.487 174.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.69 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 98.3 Cg_exo -48.71 138.12 26.02 Favored 'Trans proline' 0 CA--C 1.489 -1.764 0 C-N-CA 124.247 3.298 . . . . 0.14 113.014 -173.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.22 53.81 1.96 Allowed 'General case' 0 N--CA 1.409 -2.486 0 C-N-CA 116.785 -1.966 . . . . 0.06 111.442 173.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.19 98.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.87 0 N-CA-C 104.9 -2.259 . . . . 0.1 104.9 149.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.882 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.5 m -132.48 117.02 29.93 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.969 0 C-N-CA 118.882 -1.127 . . . . 0.14 110.223 -176.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.659 ' C ' HG21 ' A' ' 37' ' ' THR . 28.8 t70 74.01 37.86 0.6 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.935 -1.484 . . . . 0.53 109.267 -171.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.019 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.2 2.75 42.33 Favored Glycine 0 CA--C 1.504 -0.646 0 CA-C-N 115.728 -0.669 . . . . 0.1 113.003 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -129.06 136.29 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 122.514 1.15 . . . . 0.15 110.287 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.32 153.48 43.59 Favored 'General case' 0 C--N 1.288 -2.093 0 CA-C-N 113.078 -1.874 . . . . 0.11 111.837 -175.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.514 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.69 94.3 5.12 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.995 -1.457 . . . . 0.48 107.623 174.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -67.53 -13.01 61.67 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.517 1.151 . . . . 0.2 110.116 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -85.01 -3.92 58.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 112.916 -1.947 . . . . 0.9 109.611 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.626 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.6 176.33 3.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.833 -1.53 . . . . 0.2 111.138 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.694 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.8 mmmm -133.46 96.52 3.73 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 114.282 -1.326 . . . . 1.99 111.516 -169.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.509 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -65.04 100.25 0.42 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.234 -0.654 . . . . 0.13 109.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.611 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -44.13 163.18 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.179 -1.373 . . . . 0.26 113.086 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.5 m -73.85 0.27 13.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.575 0.702 . . . . 0.29 109.938 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -111.52 -13.03 13.9 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.895 -1.048 . . . . 1.51 109.018 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.754 ' HA ' ' OE1' ' A' ' 91' ' ' GLN . . . -46.35 113.1 0.57 Allowed 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 122.567 1.175 . . . . 0.15 111.801 173.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -134.67 100.92 4.77 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 112.777 -2.01 . . . . 2.22 108.207 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.36 158.09 17.92 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 113.688 0.996 . . . . 0.15 113.688 -166.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -132.4 135.34 46.05 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 113.234 -1.803 . . . . 0.2 108.03 173.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.45 69.01 0.82 Allowed 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.274 1.035 . . . . 1.36 108.945 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.438 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.7 mt -68.16 121.24 16.99 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 CA-C-N 113.327 -1.761 . . . . 0.18 112.544 -169.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 24.5 mmmt -100.33 112.43 24.77 Favored 'General case' 0 N--CA 1.427 -1.585 0 CA-C-N 114.443 -1.253 . . . . 1.87 111.342 168.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.665 HG21 ' HA ' ' A' ' 81' ' ' GLN . 64.9 p -88.52 -17.74 29.63 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 112.982 -1.917 . . . . 0.16 108.442 174.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 94.26 -14.38 65.43 Favored Glycine 0 N--CA 1.425 -2.097 0 CA-C-N 114.139 -1.391 . . . . 0.18 111.23 -170.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.518 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.0 t30 -93.6 87.65 5.58 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.453 -0.573 . . . . 0.45 109.453 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.826 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.5 m -45.81 -58.82 3.19 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 113.431 0.9 . . . . 0.26 113.431 -168.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -51.49 -37.78 50.69 Favored 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 123.428 0.455 . . . . 1.66 110.543 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.789 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.5 tp -70.69 -45.79 64.35 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.575 -0.739 . . . . 0.09 109.155 176.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.583 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.1 m-20 -54.95 -32.26 61.25 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 124.184 0.927 . . . . 1.49 108.764 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.826 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.6 mtpt -79.86 -21.47 44.07 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.43 -1.259 . . . . 1.29 112.912 175.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -93.32 -28.67 4.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.906 -0.776 . . . . 0.09 108.906 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.789 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.9 mt -55.82 -48.4 75.5 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 106.27 -1.752 . . . . 0.07 106.27 171.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.41 -48.63 78.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-N 110.488 -3.051 . . . . 0.37 111.62 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.608 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.07 -46.04 5.53 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 112.142 -2.299 . . . . 1.66 110.027 177.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.26 -51.63 35.61 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 113.987 -1.46 . . . . 0.06 109.881 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.17 -24.66 5.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 115.256 -0.884 . . . . 0.09 111.303 176.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.3 m -80.61 -11.9 59.58 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-O 121.781 0.8 . . . . 1.33 110.349 -178.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -84.55 -27.24 27.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.827 -1.079 . . . . 0.1 109.073 169.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.509 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.916 -0.935 . . . . 1.19 112.822 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.737 0 N-CA-C 112.019 -0.432 . . . . 22.48 112.019 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -103.85 -60.83 1.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.731 -0.276 . . . . 23.33 111.531 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -91.28 0.09 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.942 0.349 . . . . 22.11 111.942 -174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 56.27 88.07 0.05 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 122.911 0.484 . . . . 20.59 111.404 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.5 p -69.25 137.63 23.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.01 -0.541 . . . . 18.37 110.777 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.62 137.57 33.2 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 16.65 110.361 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.76 -32.16 72.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.443 -0.798 . . . . 17.53 110.86 -175.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 t 68.82 -71.37 0.12 Allowed 'General case' 0 CA--C 1.531 0.218 0 O-C-N 124.143 0.902 . . . . 15.09 110.777 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 29.2 m -83.49 103.25 12.69 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 120.997 0.427 . . . . 13.75 110.358 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -106.58 -56.97 2.12 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.177 -0.465 . . . . 14.58 109.754 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 65.75 137.35 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 O-C-N 124.074 0.859 . . . . 13.16 111.255 -178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.508 HD12 ' N ' ' A' ' 12' ' ' ILE . 2.6 mp -73.08 86.16 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.403 0.62 . . . . 10.1 109.879 178.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -127.59 -28.08 2.79 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.256 -0.884 . . . . 10.66 110.386 178.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.0 t -74.89 139.34 43.05 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.065 -0.516 . . . . 7.42 110.322 177.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 t 63.27 36.84 11.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.584 0.707 . . . . 6.06 109.795 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -91.72 -72.94 0.56 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.494 -0.775 . . . . 6.06 111.178 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m 55.77 72.9 0.46 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.705 -0.68 . . . . 2.91 110.354 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.464 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 78.7 p 61.13 146.71 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.341 1.057 . . . . 1.44 113.026 -178.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.515 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 22.2 m -140.74 148.8 41.27 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.703 -0.68 . . . . 1.25 109.681 173.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.638 ' CB ' HD12 ' A' ' 62' ' ' LEU . . . -84.72 172.46 11.5 Favored 'General case' 0 N--CA 1.433 -1.306 0 CA-C-N 115.281 -0.872 . . . . 0.39 111.158 -178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.4 m-80 -108.04 171.05 7.62 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.971 -1.468 . . . . 0.43 108.08 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.684 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 13.0 mm-40 -84.25 -18.38 36.66 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 119.863 1.211 . . . . 1.0 111.478 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.3 m -78.01 -10.3 59.53 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 107.493 -1.299 . . . . 1.36 107.493 171.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HB3' HD13 ' A' ' 62' ' ' LEU . 40.5 m-20 -97.97 -46.82 5.77 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 113.782 -1.554 . . . . 1.27 108.877 175.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.684 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 92.9 t -96.31 -61.64 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 CA-C-N 113.693 -1.594 . . . . 1.01 112.407 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.523 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 27.3 t70 -46.64 -51.72 15.23 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.741 0.651 . . . . 0.51 111.461 -176.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.66 -42.02 87.26 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 122.508 0.323 . . . . 0.45 110.483 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.617 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 61.0 t80 -51.98 -62.51 1.59 Allowed 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 108.028 -1.101 . . . . 0.13 108.028 176.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.9 m-80 -60.51 -26.75 67.08 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 113.38 -1.737 . . . . 0.3 111.431 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.0 m -80.44 -46.05 16.58 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.705 -0.679 . . . . 0.2 110.839 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.7 tp -70.53 -31.92 69.17 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 107.204 -1.406 . . . . 0.53 107.204 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 34.6 t80 -64.91 -47.33 78.17 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.895 -1.957 . . . . 0.15 110.878 176.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 -25.98 68.38 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 122.423 1.106 . . . . 0.52 108.689 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.12 -33.83 61.61 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 112.695 -2.048 . . . . 0.1 111.694 -175.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.1 m-85 -61.0 -20.87 63.0 Favored 'General case' 0 CA--C 1.487 -1.476 0 CA-C-O 121.61 0.719 . . . . 0.08 109.338 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.617 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.96 128.08 41.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.517 -1.22 . . . . 0.11 109.349 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.641 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -62.73 -21.86 66.11 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 113.669 -1.605 . . . . 0.17 110.288 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -140.25 156.59 46.42 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.172 -0.922 . . . . 1.52 109.063 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 p -75.12 0.62 15.6 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.99 0.424 . . . . 0.36 110.737 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 34.1 m-20 -74.18 -19.14 60.64 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.624 -0.88 . . . . 1.15 108.624 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.481 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 53.43 40.45 31.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 113.988 -1.46 . . . . 0.66 110.859 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.447 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 47.3 p -108.08 1.41 22.32 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 112.852 -1.976 . . . . 0.21 109.624 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.043 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.59 146.86 22.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.371 -1.286 . . . . 0.1 109.297 -174.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.762 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.69 140.09 53.25 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 114.485 1.291 . . . . 0.09 114.485 -172.119 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.1 mmtp -89.43 133.14 34.67 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.543 -1.662 . . . . 1.95 109.483 177.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.7 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -83.99 -22.76 31.28 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 114.352 -1.295 . . . . 1.78 111.157 -169.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 34.2 t -65.55 -26.49 67.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.466 0.65 . . . . 1.32 110.226 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.3 mm100 -77.23 -24.29 51.23 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.736 -0.665 . . . . 0.82 111.474 -178.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.53 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.82 -25.66 29.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.801 0.334 . . . . 0.13 111.824 -177.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -71.25 -23.3 61.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.048 0.928 . . . . 0.41 109.326 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.594 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.8 OUTLIER -97.43 8.92 43.67 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.175 -1.375 . . . . 1.47 110.749 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.668 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.1 -39.42 93.13 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.223 -0.591 . . . . 0.09 110.59 178.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 m -67.74 -21.55 65.28 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.202 -0.666 . . . . 1.25 109.202 172.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.92 -38.29 32.8 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.194 175.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.512 HD21 ' HB2' ' A' ' 32' ' ' TYR . 0.2 OUTLIER -65.98 -27.63 68.29 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.369 -0.974 . . . . 0.1 108.369 174.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.6 tptp -77.8 -29.16 50.6 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.612 -1.176 . . . . 0.82 108.744 173.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -72.17 -40.27 68.09 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.762 -1.108 . . . . 0.14 109.824 179.037 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.781 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.34 -39.64 68.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 115.472 -0.786 . . . . 0.16 110.331 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.664 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.8 -37.12 83.21 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.292 -0.633 . . . . 0.11 109.292 169.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.667 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.71 -22.07 66.72 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.748 0.785 . . . . 0.66 110.126 172.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 23.8 mtpp -82.78 -19.2 38.23 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.143 -0.935 . . . . 1.92 110.054 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.781 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -86.92 -24.76 24.69 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.22 -1.355 . . . . 0.14 107.503 177.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.8 mt-10 -46.1 123.99 5.12 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 113.437 -1.71 . . . . 1.75 112.383 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.73 -13.91 66.3 Favored Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.51 -0.852 . . . . 0.26 111.671 -178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.462 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -108.81 166.58 10.7 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.061 -0.718 . . . . 0.27 109.061 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.515 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 12.8 ptm180 -70.2 -29.97 66.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.22 0.533 . . . . 3.05 111.438 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.2 mm-40 -58.84 -36.16 74.09 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.149 -0.932 . . . . 2.51 109.371 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.677 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 27.7 t-80 -42.06 -46.6 4.29 Favored 'General case' 0 C--O 1.192 -1.968 0 CA-C-N 113.6 -1.636 . . . . 0.17 112.882 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 50.7 m -56.84 -53.5 57.2 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 123.002 1.382 . . . . 0.22 111.07 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.764 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.89 -44.02 86.54 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 111.731 -2.486 . . . . 0.21 107.329 -174.237 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.45 -22.2 38.29 Favored 'General case' 0 C--N 1.275 -2.668 0 CA-C-N 111.718 -2.492 . . . . 0.11 111.061 -172.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 16.9 tttm -75.46 -34.85 60.96 Favored 'General case' 0 CA--C 1.472 -2.028 0 N-CA-C 106.313 -1.736 . . . . 1.35 106.313 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 77' ' ' SER . 23.9 m -75.5 -19.16 59.56 Favored 'General case' 0 N--CA 1.428 -1.574 0 CA-C-N 113.665 -1.607 . . . . 1.18 109.839 177.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.764 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.5 mtpp -83.47 -53.85 5.4 Favored 'General case' 0 CA--C 1.487 -1.458 0 CA-C-O 122.106 0.955 . . . . 1.02 109.831 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.4 t80 -52.24 -55.63 19.96 Favored 'General case' 0 N--CA 1.424 -1.76 0 CA-C-N 113.07 -1.877 . . . . 0.25 110.666 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.619 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.8 OUTLIER -63.5 -35.68 81.25 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-O 122.825 1.298 . . . . 0.65 107.771 -170.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.586 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -62.75 -55.67 24.52 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 111.913 -2.403 . . . . 0.1 108.384 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.34 -37.44 85.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.161 -175.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.703 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.4 -33.56 75.98 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-N 113.317 -1.765 . . . . 0.07 110.084 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.472 HG22 HG22 ' A' ' 119' ' ' THR . 54.1 m -76.44 -37.36 57.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.465 -0.789 . . . . 0.07 110.504 178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.774 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.5 mt-30 -67.41 -39.85 85.55 Favored 'General case' 0 N--CA 1.41 -2.474 0 N-CA-C 109.174 -0.676 . . . . 0.09 109.174 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.762 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.94 -47.24 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 C-N-CA 118.134 -1.426 . . . . 0.06 109.265 175.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.33 -32.42 56.63 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.093 0.473 . . . . 0.95 112.155 179.18 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.632 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.95 -49.07 71.78 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.25 -0.887 . . . . 0.05 110.115 173.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.804 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.1 mt -58.63 -45.8 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.638 0 CA-C-N 113.602 -1.635 . . . . 0.05 108.048 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.99 -50.43 74.11 Favored 'General case' 0 N--CA 1.409 -2.499 0 CA-C-N 113.879 -1.51 . . . . 0.09 108.452 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.539 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -49.55 -56.25 10.57 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 124.938 1.398 . . . . 0.4 110.223 -177.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.632 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.77 -39.68 31.39 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.641 0 CA-C-N 115.102 -0.954 . . . . 0.05 110.106 -173.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.698 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.8 m-20 -57.63 -30.26 65.22 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.146 0.974 . . . . 0.09 110.126 172.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.21 -15.33 61.94 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 113.254 -1.794 . . . . 0.12 109.785 -176.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.722 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -87.96 -19.51 27.15 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.01 -1.45 . . . . 0.25 109.611 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.699 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.6 m-85 -97.54 158.43 15.49 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-O 121.963 0.887 . . . . 0.12 111.575 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.716 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 14.5 mt-10 -62.37 -25.35 67.87 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 113.443 -1.708 . . . . 0.45 109.056 175.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 28.5 pttt -146.47 145.05 22.21 Favored Pre-proline 0 CA--C 1.506 -0.716 0 CA-C-N 114.357 -1.292 . . . . 2.94 109.277 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.698 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.3 Cg_exo -46.53 136.46 15.78 Favored 'Trans proline' 0 CA--C 1.487 -1.833 0 C-N-CA 124.443 3.429 . . . . 0.14 112.925 -175.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.98 53.83 1.95 Allowed 'General case' 0 N--CA 1.409 -2.491 0 C-N-CA 116.822 -1.951 . . . . 0.06 111.47 173.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.804 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.7 mp -148.31 97.72 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.865 0 N-CA-C 104.699 -2.334 . . . . 0.1 104.699 149.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.7 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.0 m -131.74 114.73 25.68 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.978 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.12 -176.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.641 ' C ' HG21 ' A' ' 37' ' ' THR . 28.4 t70 76.77 38.92 0.25 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.394 -1.275 . . . . 0.53 109.416 -172.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.043 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.97 22.61 Favored Glycine 0 CA--C 1.503 -0.693 0 CA-C-N 115.537 -0.756 . . . . 0.1 112.888 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.35 136.48 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 122.668 1.223 . . . . 0.15 109.996 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.29 152.02 46.46 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 112.84 -1.982 . . . . 0.11 111.68 -176.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.49 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -103.24 93.86 5.21 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 113.714 -1.585 . . . . 0.48 107.211 175.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.814 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.6 p -68.78 -11.51 60.44 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-O 122.752 1.263 . . . . 0.2 109.276 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.444 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 5.5 t-20 -81.59 -6.8 59.34 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 112.464 -2.153 . . . . 0.9 109.607 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.632 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.01 175.78 6.35 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 113.592 -1.64 . . . . 0.2 111.85 -177.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.716 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.3 mmmt -136.19 95.44 3.19 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 113.649 -1.614 . . . . 1.99 111.226 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.06 101.77 0.31 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.99 -0.744 . . . . 0.13 108.99 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -47.19 165.17 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 114.709 -1.132 . . . . 0.26 113.325 -177.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.6 m -71.52 0.73 7.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.251 -0.886 . . . . 0.29 110.339 174.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.403 ' H ' ' C ' ' A' ' 109' ' ' LYS . 29.0 t70 -116.61 -14.3 10.86 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 114.729 -1.123 . . . . 1.51 108.865 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.722 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -46.73 117.35 1.61 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.335 1.064 . . . . 0.15 111.602 173.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -137.21 101.06 4.43 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.019 -1.9 . . . . 2.22 108.55 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -89.89 155.44 19.14 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.151 1.167 . . . . 0.15 114.151 -167.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -129.9 137.56 50.45 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 113.051 -1.886 . . . . 0.2 107.744 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.29 66.53 0.92 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.15 0.976 . . . . 1.36 109.186 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.45 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -65.76 121.31 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.266 0 CA-C-N 113.321 -1.763 . . . . 0.18 112.004 -170.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -107.5 111.28 23.49 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-O 122.653 1.216 . . . . 1.87 110.529 168.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.774 HG21 ' HA ' ' A' ' 81' ' ' GLN . 69.1 p -81.38 -17.31 49.44 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.46 -2.154 . . . . 0.16 108.528 175.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.75 -26.37 24.69 Favored Glycine 0 N--CA 1.426 -1.972 0 CA-C-N 114.019 -1.446 . . . . 0.18 110.669 -168.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.7 t30 -83.81 93.0 7.88 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.219 -1.03 . . . . 0.45 108.219 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.813 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 39.1 m -52.23 -56.13 16.68 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.41 -0.814 . . . . 0.26 113.173 -173.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 127' ' ' VAL . 2.1 mt-10 -58.62 -26.31 63.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.666 0.269 . . . . 1.66 110.416 -178.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -78.48 -45.23 22.58 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 109.042 -0.725 . . . . 0.09 109.042 173.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.555 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.2 m-20 -58.03 -28.96 64.96 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.016 -0.993 . . . . 1.49 109.316 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.813 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.0 mtpt -78.62 -24.57 45.24 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.583 -1.19 . . . . 1.29 112.535 174.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 123' ' ' GLU . 46.8 t -91.39 -29.13 4.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.729 0.776 . . . . 0.09 109.053 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 50.9 mt -55.24 -48.52 73.82 Favored 'General case' 0 CA--C 1.501 -0.919 0 N-CA-C 106.411 -1.7 . . . . 0.07 106.411 171.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -48.57 80.35 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-N 110.663 -2.971 . . . . 0.37 111.477 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.635 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -43.31 -44.91 5.72 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 112.486 -2.143 . . . . 1.66 110.028 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.82 -53.07 19.89 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 113.741 -1.572 . . . . 0.06 110.013 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -50.67 -25.85 3.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.581 175.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 31.7 m -79.29 -16.43 56.42 Favored 'General case' 0 N--CA 1.417 -2.098 0 CA-C-N 115.331 -0.85 . . . . 1.33 110.355 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.4 mp -78.14 -27.56 48.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.858 -1.065 . . . . 0.1 108.757 168.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.498 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.187 0 CA-C-O 118.643 -1.087 . . . . 1.19 112.908 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.969 -0.452 . . . . 22.48 111.969 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 m80 58.65 34.69 24.0 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.065 0.546 . . . . 23.33 111.36 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.3 mtp -107.49 15.61 24.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.022 -0.536 . . . . 22.11 110.036 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 60.1 87.06 0.09 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 114.841 -1.072 . . . . 20.59 111.086 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.0 t -71.35 98.47 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.759 -0.655 . . . . 18.37 110.345 178.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -129.76 -156.66 0.77 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 16.65 109.956 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -83.19 -33.67 26.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.085 0.469 . . . . 17.53 110.177 178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.2 m -82.54 106.77 14.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.946 -0.57 . . . . 15.09 110.418 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 31.2 m -77.55 128.36 34.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.788 0.327 . . . . 13.75 110.921 179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -84.59 104.37 14.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.137 0.494 . . . . 14.58 110.183 178.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.458 ' HG2' ' H ' ' A' ' 11' ' ' GLU . 3.0 pt-20 -86.77 110.32 19.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.604 -0.726 . . . . 13.16 111.286 -176.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 64.0 mt -78.1 116.7 22.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.819 -0.628 . . . . 10.1 109.941 177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -125.69 -168.37 1.83 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.787 -0.642 . . . . 10.66 109.848 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 83.3 m 70.76 -79.03 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.264 0 O-C-N 123.47 0.481 . . . . 7.42 111.167 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.8 t 54.03 -149.37 0.43 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.172 0.189 . . . . 6.06 110.927 176.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 63.57 78.74 0.28 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.224 0.61 . . . . 6.06 111.101 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m 62.03 -169.35 0.18 Allowed 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.907 -1.042 . . . . 2.91 110.986 178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 74.4 p -85.28 -176.16 6.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.946 0.403 . . . . 1.44 110.091 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.46 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 8.0 m -109.55 149.55 29.48 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.062 -1.088 . . . . 1.25 108.062 168.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.811 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -75.12 -175.83 2.79 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 122.288 1.042 . . . . 0.39 111.622 -174.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -129.66 154.59 46.98 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 113.546 -1.661 . . . . 0.43 107.109 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.576 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -78.83 -10.66 59.86 Favored 'General case' 0 C--N 1.309 -1.182 0 C-N-CA 120.01 -0.676 . . . . 1.0 111.296 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -83.26 -10.89 58.29 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.306 -0.998 . . . . 1.36 108.306 169.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.646 ' HB3' HD13 ' A' ' 62' ' ' LEU . 85.2 m-20 -98.24 -45.63 6.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.377 -1.283 . . . . 1.27 109.431 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.576 ' HB ' HE21 ' A' ' 22' ' ' GLN . 55.3 t -87.67 -52.83 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 CA-C-N 113.741 -1.572 . . . . 1.01 112.977 -167.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 24.6 t70 -53.55 -52.43 59.72 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.806 -0.634 . . . . 0.51 111.66 -174.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -68.31 -37.64 80.81 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 110.224 -0.288 . . . . 0.45 110.224 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.664 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 57.2 t80 -52.99 -63.07 1.27 Allowed 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.756 -1.201 . . . . 0.13 107.756 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -61.96 -26.17 68.04 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 113.218 -1.81 . . . . 0.3 111.492 -175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.3 m -81.02 -46.76 14.55 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 115.791 -0.641 . . . . 0.2 110.799 -176.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 18.3 tp -68.98 -33.76 74.21 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.001 -1.481 . . . . 0.53 107.001 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.586 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 44.8 t80 -62.55 -47.76 82.46 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.105 -1.862 . . . . 0.15 110.809 175.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -25.91 67.88 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.379 1.085 . . . . 0.52 108.675 178.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.71 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.02 -34.05 63.98 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 112.812 -1.994 . . . . 0.1 111.387 -176.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.725 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.3 m-85 -63.27 -19.14 64.31 Favored 'General case' 0 CA--C 1.487 -1.472 0 N-CA-C 108.943 -0.762 . . . . 0.08 108.943 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.604 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -95.87 126.11 40.89 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 114.76 -1.109 . . . . 0.11 109.114 176.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.668 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -60.86 -25.05 66.39 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 113.635 -1.62 . . . . 0.17 110.532 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.57 153.21 40.83 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 115.15 -0.932 . . . . 1.52 108.903 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.9 p -69.19 -0.76 6.45 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 123.174 0.296 . . . . 0.36 111.773 -174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.468 ' O ' HG23 ' A' ' 42' ' ' THR . 1.0 OUTLIER -69.46 -19.78 63.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.806 -0.812 . . . . 1.15 108.806 170.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 51.23 39.84 24.71 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.229 -1.35 . . . . 0.66 110.97 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.543 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 34.5 p -107.77 0.46 22.28 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 112.508 -2.133 . . . . 0.21 109.748 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.18 145.31 21.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.336 -1.302 . . . . 0.1 108.994 -172.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.712 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.25 137.65 54.49 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 114.958 1.466 . . . . 0.09 114.958 -171.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 35' ' ' PHE . 47.6 mmtt -81.31 134.22 35.55 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 113.205 -1.816 . . . . 1.95 109.063 174.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -88.48 -15.89 34.16 Favored 'General case' 0 C--N 1.275 -2.674 0 CA-C-N 112.998 -1.91 . . . . 1.78 110.415 -167.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -75.75 -31.22 59.48 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.286 -0.87 . . . . 1.32 110.509 177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.675 ' CG ' ' HA ' ' A' ' 35' ' ' PHE . 3.9 mm100 -69.55 -20.11 63.68 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 116.48 -0.327 . . . . 0.82 111.73 -177.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.48 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.6 m-30 -55.05 -22.83 17.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.848 0.356 . . . . 0.13 111.86 -174.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -74.07 -28.31 61.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 122.034 0.921 . . . . 0.41 109.275 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.581 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -94.18 9.98 35.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.219 -1.355 . . . . 1.47 110.293 -178.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.67 -37.71 85.34 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.483 -0.487 . . . . 0.09 110.478 177.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.2 t -70.8 -20.47 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.775 -0.824 . . . . 1.25 108.775 172.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.718 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -78.84 -37.2 41.04 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.24 109.901 174.357 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.5 -26.87 66.57 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.708 -0.849 . . . . 0.1 108.708 174.51 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.498 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 5.7 tptp -79.3 -24.17 43.05 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 114.792 -1.095 . . . . 0.82 108.516 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.718 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -78.45 -38.81 40.33 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.463 -1.699 . . . . 0.14 110.167 179.39 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.785 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.6 mt -74.43 -37.43 63.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.467 -0.788 . . . . 0.16 109.969 175.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.625 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -63.46 -36.48 83.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.106 -0.701 . . . . 0.11 109.106 169.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.815 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 3.3 t0 -58.42 -29.56 66.19 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.174 0.987 . . . . 0.66 109.25 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 33.8 mtpt -77.58 -18.13 57.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.717 -1.129 . . . . 1.92 109.902 178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -90.48 -23.26 21.01 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.206 -1.361 . . . . 0.14 107.806 176.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.815 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 14.2 mt-10 -46.64 128.51 10.57 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 113.913 -1.494 . . . . 1.75 112.155 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.99 -17.92 57.16 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.266 -0.879 . . . . 0.26 111.482 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.425 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 3.8 m -108.24 157.01 18.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.037 -0.727 . . . . 0.27 109.037 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 18' ' ' THR . 7.5 ptp180 -64.0 -28.22 69.66 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.071 0.462 . . . . 3.05 112.095 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.811 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.1 mp0 -59.69 -35.51 74.63 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 115.71 -0.677 . . . . 2.51 111.211 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.66 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 32.9 t-80 -42.12 -44.67 3.74 Favored 'General case' 0 C--O 1.19 -2.032 0 CA-C-N 113.988 -1.46 . . . . 0.17 112.164 173.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 56.0 m -55.94 -54.23 47.29 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-O 122.875 1.321 . . . . 0.22 111.041 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.771 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.1 -44.31 89.24 Favored 'General case' 0 CA--C 1.475 -1.939 0 CA-C-N 111.848 -2.433 . . . . 0.21 107.41 -174.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.474 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.22 -20.83 36.92 Favored 'General case' 0 N--CA 1.405 -2.689 0 CA-C-N 111.88 -2.418 . . . . 0.11 111.108 -172.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 24.5 tttp -76.82 -34.74 57.89 Favored 'General case' 0 N--CA 1.42 -1.941 0 N-CA-C 106.397 -1.705 . . . . 1.35 106.397 171.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 77' ' ' SER . 39.5 m -74.91 -19.16 60.25 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 113.849 -1.523 . . . . 1.18 109.841 177.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.771 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.9 mtpp -83.5 -54.68 4.78 Favored 'General case' 0 CA--C 1.492 -1.269 0 CA-C-O 122.082 0.944 . . . . 1.02 109.658 170.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.2 t80 -51.96 -56.21 15.58 Favored 'General case' 0 N--CA 1.426 -1.665 0 CA-C-N 113.158 -1.837 . . . . 0.25 110.967 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.667 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -64.8 -32.29 73.91 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-O 122.725 1.25 . . . . 0.65 108.04 -170.13 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.605 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.2 t -64.88 -56.27 14.36 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-N 112.232 -2.258 . . . . 0.1 108.494 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.725 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.64 -36.98 85.27 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 113.053 -1.885 . . . . 0.04 109.274 -175.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.714 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.61 -33.19 75.1 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.343 -1.753 . . . . 0.07 110.22 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.434 HG22 HG22 ' A' ' 119' ' ' THR . 54.9 m -77.16 -37.86 52.97 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.469 -0.787 . . . . 0.07 110.586 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.733 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.7 mt-30 -66.42 -40.45 89.56 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.306 -0.627 . . . . 0.09 109.306 -178.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.712 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.9 -48.73 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.332 0 C-N-CA 117.901 -1.52 . . . . 0.06 109.309 174.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.714 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 6.9 mptt -51.79 -33.97 37.8 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 112.513 0.561 . . . . 0.95 112.513 178.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.617 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.59 -49.38 71.38 Favored 'General case' 0 CA--C 1.477 -1.843 0 CA-C-N 115.248 -0.887 . . . . 0.05 110.183 173.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.835 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.9 mt -58.86 -44.98 91.83 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.674 0 CA-C-N 113.615 -1.629 . . . . 0.05 108.101 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.625 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.03 -49.98 75.81 Favored 'General case' 0 N--CA 1.406 -2.633 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.544 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -49.6 -56.22 10.77 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 125.071 1.482 . . . . 0.4 110.299 -178.01 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.617 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.74 -40.56 32.62 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 CA-C-N 115.144 -0.935 . . . . 0.05 110.161 -173.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.4 m-20 -57.2 -30.15 64.31 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 122.088 0.946 . . . . 0.09 110.016 172.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.01 -13.96 61.33 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.506 -1.679 . . . . 0.12 109.855 -175.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -89.24 -19.35 25.5 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 113.961 -1.472 . . . . 0.25 109.369 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.717 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.1 m-85 -98.18 158.8 15.34 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.198 0.999 . . . . 0.12 111.761 176.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.679 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 30.9 mt-10 -64.51 -23.07 67.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 113.199 -1.819 . . . . 0.45 109.175 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 41.2 pttt -146.58 145.58 23.88 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.306 -1.316 . . . . 2.94 109.342 170.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 84.9 Cg_exo -47.85 136.23 22.58 Favored 'Trans proline' 0 CA--C 1.486 -1.886 0 C-N-CA 124.088 3.192 . . . . 0.14 112.56 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.924 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.48 53.88 1.92 Allowed 'General case' 0 N--CA 1.406 -2.649 0 C-N-CA 116.813 -1.955 . . . . 0.06 111.213 173.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.835 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -147.88 97.09 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 N-CA-C 105.443 -2.058 . . . . 0.1 105.443 149.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 28.2 m -130.74 107.29 13.87 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.963 0 C-N-CA 118.915 -1.114 . . . . 0.14 109.654 -175.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.668 ' C ' HG21 ' A' ' 37' ' ' THR . 38.7 t70 82.06 41.46 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 113.301 -1.772 . . . . 0.53 109.431 -172.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.025 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.47 2.07 18.91 Favored Glycine 0 CA--C 1.504 -0.651 0 C-N-CA 120.843 -0.694 . . . . 0.1 112.878 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.6 p -128.4 136.3 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.512 0 CA-C-O 122.685 1.231 . . . . 0.15 110.381 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.924 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.69 154.92 40.41 Favored 'General case' 0 C--N 1.288 -2.091 0 CA-C-N 112.975 -1.921 . . . . 0.11 111.8 -176.143 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.516 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.4 OUTLIER -106.71 94.31 5.05 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 113.845 -1.525 . . . . 0.48 107.511 174.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.2 -12.67 61.36 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 122.705 1.241 . . . . 0.2 109.556 -178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -81.32 -7.66 59.61 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 112.601 -2.091 . . . . 0.9 109.726 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.86 173.95 6.72 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.582 -1.645 . . . . 0.2 111.523 -177.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.679 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -133.37 95.91 3.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 113.629 -1.623 . . . . 1.99 111.182 -168.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.52 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.87 100.73 0.32 Allowed 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.945 -0.761 . . . . 0.13 108.945 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.628 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.8 mtmt -45.67 165.73 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.494 -1.23 . . . . 0.26 113.536 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -72.26 1.1 8.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.864 0.84 . . . . 0.29 110.06 173.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 109' ' ' LYS . 25.6 t70 -115.83 -14.49 11.33 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 114.348 -1.297 . . . . 1.51 108.88 -176.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -49.14 117.34 2.08 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 122.666 1.222 . . . . 0.15 112.141 174.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.6 tttm -135.07 102.1 5.09 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.652 -2.067 . . . . 2.22 108.116 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.674 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.4 m-85 -89.04 156.02 19.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 122.409 1.099 . . . . 0.15 113.839 -169.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.09 134.23 49.12 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 112.768 -2.015 . . . . 0.2 107.915 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.03 67.67 0.42 Allowed 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 122.216 1.008 . . . . 1.36 109.299 177.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.8 mt -69.29 121.48 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 113.514 -1.676 . . . . 0.18 112.215 -171.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -110.29 103.32 11.97 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.115 -1.402 . . . . 1.87 110.276 169.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.733 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.5 p -74.92 -16.25 60.66 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 112.851 -1.977 . . . . 0.16 108.845 175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.59 -20.68 48.51 Favored Glycine 0 N--CA 1.423 -2.175 0 CA-C-N 114.275 -1.33 . . . . 0.18 110.429 -170.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.6 t30 -87.97 86.98 7.21 Favored 'General case' 0 C--O 1.214 -0.804 0 N-CA-C 107.702 -1.222 . . . . 0.45 107.702 174.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.837 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 46.2 m -50.77 -51.9 46.0 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 113.329 0.863 . . . . 0.26 113.329 -172.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.761 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -58.56 -30.21 66.98 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 120.804 0.335 . . . . 1.66 110.491 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 11.3 tp -76.68 -44.4 33.84 Favored 'General case' 0 CA--C 1.495 -1.135 0 N-CA-C 108.256 -1.016 . . . . 0.09 108.256 173.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 25.8 m-20 -56.67 -30.91 63.89 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 113.696 -1.593 . . . . 1.49 109.417 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.837 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.1 mtpt -78.92 -23.74 44.5 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.523 -1.217 . . . . 1.29 112.241 174.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.761 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.9 t -92.27 -28.13 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 108.897 -0.779 . . . . 0.09 108.897 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 53.5 mt -56.14 -48.79 75.56 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.381 -1.711 . . . . 0.07 106.381 170.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 -46.88 86.92 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 110.673 -2.967 . . . . 0.37 111.34 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.647 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.19 -45.38 8.35 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 112.48 -2.145 . . . . 1.66 109.905 177.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.717 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.89 -51.38 33.61 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 113.664 -1.607 . . . . 0.06 109.743 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.674 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.56 -24.06 5.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.239 -0.892 . . . . 0.09 111.486 176.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 4.1 t -79.61 -17.46 53.78 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.257 -0.883 . . . . 1.33 109.641 -178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -78.8 -26.92 44.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.779 -1.1 . . . . 0.1 108.927 170.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.52 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.851 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.838 178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.961 -0.456 . . . . 22.48 111.961 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -114.56 21.98 14.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 23.33 110.978 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.49 -23.77 25.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.516 -0.311 . . . . 22.11 110.694 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 67.54 -76.1 0.06 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.922 0.764 . . . . 20.59 111.568 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.3 t -90.03 59.89 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.501 0.667 . . . . 18.37 109.95 -178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.42 18.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.788 -0.642 . . . . 16.65 110.837 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 -100.51 -31.83 11.08 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.136 -0.484 . . . . 17.53 110.953 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 32.2 m 67.15 -70.45 0.11 Allowed 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.96 0.788 . . . . 15.09 111.085 -178.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 27.1 m -153.19 132.74 12.97 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.991 -0.744 . . . . 13.75 108.991 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 1.08 5.87 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.694 -0.402 . . . . 14.58 111.224 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.92 149.4 51.66 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.935 -0.394 . . . . 13.16 109.935 177.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 65.5 mt -80.04 80.95 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.396 0.617 . . . . 10.1 110.091 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -129.72 -179.16 5.03 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.725 -0.67 . . . . 10.66 109.866 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.5 m 54.6 33.27 18.78 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.836 0.827 . . . . 7.42 111.042 172.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 m -88.08 71.91 9.24 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.773 -0.649 . . . . 6.06 110.447 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -122.44 -64.09 1.22 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.368 -0.833 . . . . 6.06 110.216 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 53.6 m -91.04 -165.91 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.967 -0.56 . . . . 2.91 110.479 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.545 ' O ' ' HG2' ' A' ' 66' ' ' ARG . 81.5 p -72.77 -159.64 0.06 Allowed 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.611 0.243 . . . . 1.44 110.674 178.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.553 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 40.6 m -118.15 147.41 43.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.293 -0.632 . . . . 1.25 109.293 167.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.27 -170.32 1.42 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 122.071 0.939 . . . . 0.39 111.578 -175.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.6 m-80 -131.43 155.64 46.98 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 113.807 -1.542 . . . . 0.43 106.982 -173.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.636 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -77.47 -13.07 60.0 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 118.975 0.807 . . . . 1.0 110.959 -178.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.7 t -81.03 -11.9 59.45 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.986 -1.116 . . . . 1.36 107.986 171.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.628 ' HB3' HD13 ' A' ' 62' ' ' LEU . 67.7 m-20 -98.21 -45.21 6.28 Favored 'General case' 0 N--CA 1.432 -1.356 0 CA-C-N 114.206 -1.361 . . . . 1.27 109.155 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.636 ' HB ' HE21 ' A' ' 22' ' ' GLN . 50.7 t -88.55 -51.46 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-N 113.591 -1.641 . . . . 1.01 113.041 -166.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 23.1 t70 -56.49 -52.31 65.19 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.228 -0.442 . . . . 0.51 111.569 -175.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.64 -37.83 88.9 Favored 'General case' 0 CA--C 1.501 -0.928 0 N-CA-C 109.944 -0.391 . . . . 0.45 109.944 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.648 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 65.7 t80 -53.45 -63.57 1.1 Allowed 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 107.86 -1.163 . . . . 0.13 107.86 174.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.64 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.3 m-80 -62.31 -26.03 68.19 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.257 -1.792 . . . . 0.3 111.693 -175.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.8 m -79.96 -47.61 14.7 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.664 -0.698 . . . . 0.2 110.91 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -67.26 -34.68 77.94 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 106.814 -1.55 . . . . 0.53 106.814 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.604 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.2 t80 -61.83 -48.12 82.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.749 -2.023 . . . . 0.15 110.88 176.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.08 -24.67 66.76 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-O 122.31 1.053 . . . . 0.52 108.885 178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.22 -32.81 59.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 112.809 -1.996 . . . . 0.1 111.405 -175.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.74 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.0 m-85 -60.76 -23.61 65.1 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 108.965 -0.754 . . . . 0.08 108.965 176.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.639 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.6 m-85 -93.87 126.79 39.27 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.482 -1.236 . . . . 0.11 109.616 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.7 p -64.84 -23.06 67.12 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 113.468 -1.696 . . . . 0.17 110.723 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.563 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 34.4 p-10 -137.94 152.72 49.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.435 -0.95 . . . . 1.52 108.435 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 p -74.95 -2.91 29.22 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.709 -0.396 . . . . 0.36 111.601 -176.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.563 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 17.6 m120 -74.23 -16.79 60.95 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 109.053 -0.721 . . . . 1.15 109.053 169.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.582 ' HZ3' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 56.23 41.92 28.67 Favored 'General case' 0 CA--C 1.505 -0.756 0 CA-C-N 114.314 -1.312 . . . . 0.66 110.672 174.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.498 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 57.4 p -108.02 1.86 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 112.638 -2.074 . . . . 0.21 109.553 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.085 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.31 147.08 24.3 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.454 -1.248 . . . . 0.1 109.553 -173.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.94 141.11 51.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.951 1.463 . . . . 0.09 114.951 -172.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HG2' HG22 ' A' ' 37' ' ' THR . 9.9 mmtp -90.18 130.99 36.26 Favored 'General case' 0 CA--C 1.494 -1.176 0 CA-C-N 113.436 -1.711 . . . . 1.95 109.712 178.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.844 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 10.5 m-80 -80.06 -21.56 43.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.097 -0.956 . . . . 1.78 111.862 -172.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.8 m -66.52 -28.42 68.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.63 0.729 . . . . 1.32 110.408 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.544 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.4 mm100 -74.3 -23.0 59.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.413 -0.812 . . . . 0.82 111.44 -178.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.611 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.1 m-30 -58.17 -22.2 50.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.044 0.449 . . . . 0.13 111.6 -176.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -72.09 -25.29 61.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 122.196 0.998 . . . . 0.41 109.22 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.65 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.6 mttt -97.82 10.39 40.27 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 113.793 -1.549 . . . . 1.47 110.145 -178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.57 -39.52 80.98 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.49 -0.484 . . . . 0.09 110.341 178.062 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.9 p -67.16 -23.3 65.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.966 -0.753 . . . . 1.25 108.966 171.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.689 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 1.1 tt0 -78.38 -37.25 44.55 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.877 -1.056 . . . . 1.24 110.192 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.05 -28.07 67.91 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.37 -0.974 . . . . 0.1 108.37 174.539 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.7 tptp -77.63 -28.28 51.33 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.33 -1.304 . . . . 0.82 108.523 173.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.689 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.96 -39.65 66.0 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.623 -1.171 . . . . 0.14 109.864 178.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.767 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.6 mt -72.45 -40.3 67.13 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.434 176.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.46 -37.58 84.1 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.231 -0.655 . . . . 0.11 109.231 169.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.729 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -61.8 -23.97 66.57 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.747 0.784 . . . . 0.66 109.881 172.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.673 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.6 mttt -80.88 -18.47 47.19 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 115.063 -0.971 . . . . 1.92 110.013 174.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.767 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.15 -22.82 22.65 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.313 -1.312 . . . . 0.14 107.769 177.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.729 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -45.49 129.98 8.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 113.719 -1.582 . . . . 1.75 112.281 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.412 ' O ' ' HB3' ' A' ' 17' ' ' SER . . . 90.64 -15.19 60.96 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.811 -0.709 . . . . 0.26 111.587 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.514 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.8 m -109.19 159.84 16.59 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.288 -0.634 . . . . 0.27 109.288 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 14.4 ptt85 -69.1 -24.42 64.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.071 0.462 . . . . 3.05 111.806 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.765 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 6.0 mm-40 -60.66 -38.04 83.53 Favored 'General case' 0 CA--C 1.489 -1.402 0 CA-C-N 115.664 -0.698 . . . . 2.51 109.419 178.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.632 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.38 -44.5 2.82 Favored 'General case' 0 C--O 1.188 -2.182 0 CA-C-N 114.049 -1.432 . . . . 0.17 112.437 176.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.1 m -58.03 -54.45 46.76 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 123.034 1.397 . . . . 0.22 111.21 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.785 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.39 -43.83 89.45 Favored 'General case' 0 CA--C 1.475 -1.916 0 CA-C-N 111.97 -2.377 . . . . 0.21 107.403 -174.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.99 -21.1 37.27 Favored 'General case' 0 N--CA 1.404 -2.733 0 CA-C-N 111.786 -2.461 . . . . 0.11 110.834 -172.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 25.1 tttt -76.59 -34.94 58.39 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 106.3 -1.741 . . . . 1.35 106.3 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 77' ' ' SER . 30.3 t -75.33 -18.26 60.06 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.814 -1.539 . . . . 1.18 109.523 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.785 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -84.11 -54.54 4.76 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.977 0.894 . . . . 1.02 109.791 170.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.0 t80 -51.19 -55.79 16.16 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.21 -1.814 . . . . 0.25 110.828 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.2 t70 -62.46 -36.99 84.21 Favored 'General case' 0 CA--C 1.495 -1.163 0 CA-C-O 122.929 1.347 . . . . 0.65 107.956 -171.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.607 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.11 -56.08 22.49 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 111.548 -2.569 . . . . 0.1 108.58 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.74 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.86 -37.01 85.04 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 112.919 -1.946 . . . . 0.04 109.068 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.63 -34.29 77.55 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 113.251 -1.795 . . . . 0.07 110.109 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 119' ' ' THR . 53.6 m -75.79 -38.17 58.49 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.518 -0.764 . . . . 0.07 110.619 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.728 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.6 mt-30 -67.38 -39.32 85.62 Favored 'General case' 0 N--CA 1.411 -2.424 0 N-CA-C 109.299 -0.63 . . . . 0.09 109.299 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.91 -47.9 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.257 0 C-N-CA 118.052 -1.459 . . . . 0.06 109.38 174.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.69 -31.95 49.88 Favored 'General case' 0 CA--C 1.507 -0.69 0 CA-C-O 121.11 0.481 . . . . 0.95 112.01 179.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.626 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.75 -49.56 67.97 Favored 'General case' 0 CA--C 1.478 -1.795 0 CA-C-N 115.01 -0.996 . . . . 0.05 110.207 173.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.738 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.0 mt -58.72 -44.24 89.55 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.583 0 CA-C-N 113.636 -1.62 . . . . 0.05 108.01 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.628 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.19 -52.46 65.58 Favored 'General case' 0 N--CA 1.406 -2.651 0 CA-C-N 114.082 -1.417 . . . . 0.09 108.425 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.3 t70 -46.9 -58.52 3.86 Favored 'General case' 0 CA--C 1.49 -1.333 0 O-C-N 124.943 1.402 . . . . 0.4 109.82 -178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.84 -40.74 46.57 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 114.568 -1.197 . . . . 0.05 110.374 -172.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.2 m-20 -58.67 -29.4 66.56 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.964 0.888 . . . . 0.09 110.067 173.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.9 -10.6 59.56 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 113.577 -1.647 . . . . 0.12 109.542 -176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.707 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -90.8 -19.58 23.3 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 114.275 -1.329 . . . . 0.25 109.265 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.686 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.3 m-85 -97.17 158.25 15.54 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.992 0.901 . . . . 0.12 111.275 175.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.684 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 19.3 mt-10 -64.72 -24.97 67.74 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.376 -1.738 . . . . 0.45 109.094 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -145.66 142.86 18.52 Favored Pre-proline 0 CA--C 1.514 -0.428 0 CA-C-N 114.354 -1.293 . . . . 2.94 108.271 174.137 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.3 Cg_exo -48.92 135.32 29.09 Favored 'Trans proline' 0 CA--C 1.487 -1.835 0 C-N-CA 124.043 3.162 . . . . 0.14 112.944 -173.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.855 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.98 53.18 1.94 Allowed 'General case' 0 N--CA 1.409 -2.489 0 C-N-CA 117.031 -1.868 . . . . 0.06 111.355 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.738 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.56 99.49 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.209 0 N-CA-C 103.947 -2.612 . . . . 0.1 103.947 148.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.8 m -133.28 119.48 35.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.636 0 C-N-CA 119.577 -0.849 . . . . 0.14 109.783 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 70.31 39.4 1.27 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.467 -1.242 . . . . 0.53 109.236 -171.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.085 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.01 3.14 34.77 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.344 -0.843 . . . . 0.1 113.335 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.91 135.67 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 122.604 1.192 . . . . 0.15 110.188 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.855 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.06 150.17 49.58 Favored 'General case' 0 C--N 1.288 -2.087 0 CA-C-N 113.069 -1.878 . . . . 0.11 111.565 -176.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.497 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -103.24 95.64 6.24 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 113.779 -1.555 . . . . 0.48 107.536 176.215 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -70.43 -12.31 61.49 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 122.888 1.327 . . . . 0.2 109.309 -175.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.59 -3.51 58.89 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.202 -2.272 . . . . 0.9 109.175 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.674 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.58 178.25 3.63 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 113.892 -1.504 . . . . 0.2 111.04 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.684 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 6.0 mmmm -135.87 96.36 3.4 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 114.346 -1.297 . . . . 1.99 111.418 -169.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.04 99.44 0.51 Allowed 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.4 mtmt -44.48 161.81 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 114.663 -1.153 . . . . 0.26 113.316 -177.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 69.9 m -70.03 0.21 6.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.721 0.772 . . . . 0.29 110.658 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 109' ' ' LYS . 26.9 t70 -114.65 -15.01 12.01 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.838 -1.074 . . . . 1.51 108.658 -176.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.707 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.05 119.48 2.58 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 122.37 1.081 . . . . 0.15 111.407 173.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -138.21 101.38 4.38 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 112.801 -1.999 . . . . 2.22 108.201 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.705 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.7 m-85 -89.45 156.39 18.69 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 113.968 1.099 . . . . 0.15 113.968 -167.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.69 136.06 50.1 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.899 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.33 68.3 0.52 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 122.18 0.991 . . . . 1.36 109.083 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.467 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.5 mt -67.43 121.21 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 CA-C-N 113.438 -1.71 . . . . 0.18 111.979 -171.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -104.31 114.21 28.3 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 114.427 -1.26 . . . . 1.87 110.255 168.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.728 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.1 p -87.05 -17.23 33.41 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 113.255 -1.793 . . . . 0.16 108.426 174.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.46 -14.61 64.89 Favored Glycine 0 N--CA 1.425 -2.095 0 CA-C-N 114.031 -1.441 . . . . 0.18 111.155 -169.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.9 t30 -91.72 84.11 5.39 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.348 -0.612 . . . . 0.45 109.348 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.803 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 31.4 m -43.6 -58.66 2.54 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.73 1.011 . . . . 0.26 113.73 -169.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.801 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.6 mt-10 -54.31 -34.33 60.75 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 123.252 0.345 . . . . 1.66 110.637 -178.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.732 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.4 tp -72.24 -46.08 57.51 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.998 -0.741 . . . . 0.09 108.998 174.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.589 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -55.7 -33.07 63.85 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.137 -0.938 . . . . 1.49 109.072 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.803 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.8 mtpp -74.96 -26.71 59.79 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 114.539 -1.21 . . . . 1.29 112.283 176.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.2 t -89.81 -29.32 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 N-CA-C 108.701 -0.851 . . . . 0.09 108.701 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.42 -49.5 72.25 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 106.436 -1.691 . . . . 0.07 106.436 171.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.91 -47.61 82.33 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 110.816 -2.902 . . . . 0.37 111.642 179.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.666 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.38 -44.0 11.55 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.607 -2.088 . . . . 1.66 110.148 178.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -68.89 -53.24 22.25 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 113.784 -1.553 . . . . 0.06 109.657 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.705 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -51.53 -24.7 4.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.233 -0.894 . . . . 0.09 111.626 175.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 37.6 m -80.97 -14.32 58.07 Favored 'General case' 0 N--CA 1.417 -2.113 0 CA-C-N 115.511 -0.768 . . . . 1.33 110.341 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -80.67 -29.84 36.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.987 -1.006 . . . . 0.1 108.537 167.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.741 -1.033 . . . . 1.19 112.517 179.322 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 111.684 -0.566 . . . . 22.48 111.684 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 44.7 p-80 -78.03 -25.37 47.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.085 0.469 . . . . 23.33 110.064 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.2 mtp -148.81 127.02 12.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.527 -0.761 . . . . 22.11 109.98 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -83.51 67.33 9.33 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.128 0.49 . . . . 20.59 109.861 177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.0 t 69.42 -73.86 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 114.949 -1.023 . . . . 18.37 110.797 -175.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 54.19 77.55 0.19 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.0 -0.545 . . . . 16.65 111.196 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 -65.21 -10.48 32.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.013 -0.539 . . . . 17.53 111.812 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -80.51 7.86 9.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.987 0.422 . . . . 15.09 110.76 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 65.2 m -95.91 112.22 24.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.21 -0.45 . . . . 13.75 110.86 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.53 63.68 0.8 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.433 0.635 . . . . 14.58 109.426 177.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -164.88 160.66 19.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.229 -0.896 . . . . 13.16 108.606 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 56.0 mt -74.02 82.32 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.532 0.682 . . . . 10.1 111.096 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -136.85 -46.91 0.59 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.224 -0.898 . . . . 10.66 110.132 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.9 m -66.24 162.72 19.38 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 7.42 110.41 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.441 ' HB2' ' OG1' ' A' ' 19' ' ' THR . 46.6 m -54.6 159.55 2.11 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.222 0.534 . . . . 6.06 111.725 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.95 126.56 28.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.508 -0.769 . . . . 6.06 111.528 -175.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.5 m 66.73 -168.37 0.2 Allowed 'General case' 0 C--O 1.234 0.268 0 O-C-N 124.005 0.816 . . . . 2.91 111.044 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 3.7 p -61.22 129.17 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.104 0.478 . . . . 1.44 111.077 175.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.588 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 25.7 m -128.86 147.86 50.85 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.314 0.578 . . . . 1.25 110.478 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.623 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -81.48 164.4 22.04 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 122.083 0.944 . . . . 0.39 111.788 -175.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.5 m-80 -104.55 159.72 15.52 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 113.075 -1.875 . . . . 0.43 107.941 -174.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.61 HE21 ' HB ' ' A' ' 25' ' ' VAL . 0.9 OUTLIER -78.64 -14.09 59.49 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 119.778 -0.769 . . . . 1.0 110.909 -178.258 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -80.69 -11.33 59.64 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.26 -1.015 . . . . 1.36 108.26 170.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.633 ' HB3' HD13 ' A' ' 62' ' ' LEU . 75.6 m-20 -97.12 -44.66 6.86 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.201 -1.363 . . . . 1.27 108.907 176.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.61 ' HB ' HE21 ' A' ' 22' ' ' GLN . 66.9 t -89.91 -54.75 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 113.604 -1.635 . . . . 1.01 113.154 -167.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.38 -51.67 66.06 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.25 -0.432 . . . . 0.51 111.278 -174.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.85 -38.63 91.62 Favored 'General case' 0 CA--C 1.498 -1.021 0 N-CA-C 109.823 -0.436 . . . . 0.45 109.823 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.572 ' CE1' HD13 ' A' ' 55' ' ' LEU . 71.6 t80 -54.05 -63.94 0.99 Allowed 'General case' 0 CA--C 1.495 -1.148 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 175.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.576 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.2 m-80 -60.47 -28.67 68.51 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 113.345 -1.752 . . . . 0.3 111.334 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 m -79.56 -46.32 17.55 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 115.577 -0.738 . . . . 0.2 111.015 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.9 tp -69.89 -32.21 70.42 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 107.074 -1.454 . . . . 0.53 107.074 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.725 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.2 t80 -64.14 -48.41 76.17 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 113.145 -1.843 . . . . 0.15 110.694 175.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.94 -24.99 67.69 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 122.485 1.136 . . . . 0.52 108.723 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -74.71 -32.35 62.13 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 112.816 -1.993 . . . . 0.1 111.497 -176.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.0 m-85 -62.76 -21.09 65.58 Favored 'General case' 0 CA--C 1.489 -1.393 0 N-CA-C 108.993 -0.743 . . . . 0.08 108.993 177.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.611 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 78.4 m-85 -95.76 128.0 42.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 114.594 -1.184 . . . . 0.11 109.346 178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.637 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.1 p -64.7 -21.88 66.85 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 113.863 -1.517 . . . . 0.17 110.176 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.585 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 32.8 p-10 -140.16 150.8 44.67 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.949 -1.023 . . . . 1.52 108.545 -177.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.4 p -74.64 -1.83 23.45 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.802 -0.359 . . . . 0.36 111.451 -177.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.585 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 93.0 m-20 -74.88 -17.21 60.62 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.532 0.682 . . . . 1.15 109.199 169.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.3 mtpt 55.3 42.42 30.31 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-N 114.06 -1.427 . . . . 0.66 110.532 174.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.447 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 53.8 p -109.72 -0.4 18.54 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 112.675 -2.057 . . . . 0.21 109.22 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.008 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -150.85 143.84 24.65 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.227 -1.351 . . . . 0.1 109.374 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.772 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.4 139.29 54.01 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 114.6 1.333 . . . . 0.09 114.6 -172.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.421 ' HG2' HG22 ' A' ' 37' ' ' THR . 13.9 mmtm -86.66 135.55 33.36 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.651 -1.613 . . . . 1.95 109.013 176.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -86.01 -27.69 24.65 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 114.51 -1.223 . . . . 1.78 112.224 -168.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 m -63.51 -27.61 69.39 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.305 0.574 . . . . 1.32 110.666 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.545 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.3 mm100 -72.0 -22.96 61.35 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.02 -0.536 . . . . 0.82 111.571 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.501 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.2 m-30 -56.52 -26.85 55.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.013 0.435 . . . . 0.13 111.648 -175.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.48 -27.64 67.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 122.106 0.955 . . . . 0.41 109.691 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.58 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.1 mmtm -93.45 7.43 44.56 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-N 114.067 -1.424 . . . . 1.47 110.273 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.661 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.85 -38.77 92.1 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 120.291 -0.564 . . . . 0.09 110.349 177.386 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.3 p -68.68 -23.8 64.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.521 0.677 . . . . 1.25 109.387 172.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.677 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -77.96 -37.7 46.92 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 115.23 -0.895 . . . . 1.24 110.342 175.493 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.572 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -66.39 -27.14 67.62 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.415 -0.958 . . . . 0.1 108.415 175.257 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.5 tptp -78.41 -29.46 47.17 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 114.627 -1.169 . . . . 0.82 108.63 173.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -71.2 -38.7 72.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.61 -1.177 . . . . 0.14 109.975 178.273 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -74.3 -40.32 62.34 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.388 -0.824 . . . . 0.16 110.405 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.636 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.23 -35.73 79.81 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.29 -0.633 . . . . 0.11 109.29 169.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.705 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.41 -24.19 67.73 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.872 0.844 . . . . 0.66 109.788 172.285 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 41.6 mttp -80.23 -19.85 45.95 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.67 -1.15 . . . . 1.92 110.162 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -88.53 -22.8 23.4 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.276 -1.329 . . . . 0.14 107.775 177.572 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.705 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 7.2 mt-10 -46.14 129.41 10.02 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 113.677 -1.601 . . . . 1.75 112.361 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.35 -13.93 60.72 Favored Glycine 0 N--CA 1.438 -1.233 0 CA-C-N 115.264 -0.88 . . . . 0.26 111.984 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.437 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.3 m -108.58 159.47 16.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.125 -0.695 . . . . 0.27 109.125 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.5 ptm180 -66.34 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.191 0.441 . . . . 3.05 112.191 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.0 mm-40 -61.2 -36.44 79.89 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 121.52 0.676 . . . . 2.51 109.374 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.658 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.2 t-80 -42.39 -45.29 4.29 Favored 'General case' 0 C--O 1.192 -1.965 0 CA-C-N 113.498 -1.683 . . . . 0.17 112.742 178.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.1 m -56.78 -53.13 61.3 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 122.959 1.362 . . . . 0.22 111.019 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.809 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.27 -44.03 84.73 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 111.691 -2.504 . . . . 0.21 107.284 -174.353 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.09 -21.83 36.59 Favored 'General case' 0 C--N 1.276 -2.601 0 CA-C-N 111.851 -2.432 . . . . 0.11 111.207 -172.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.721 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.4 tttp -76.31 -34.09 59.03 Favored 'General case' 0 N--CA 1.422 -1.841 0 N-CA-C 106.236 -1.764 . . . . 1.35 106.236 171.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.437 ' O ' ' HB2' ' A' ' 77' ' ' SER . 9.0 t -75.32 -18.25 60.06 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 113.581 -1.645 . . . . 1.18 109.48 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.2 mtpp -85.02 -54.64 4.51 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-O 121.987 0.898 . . . . 1.02 109.791 170.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 18.8 t80 -52.5 -56.91 11.92 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 113.263 -1.79 . . . . 0.25 111.046 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.721 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.07 -28.09 68.57 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 122.59 1.186 . . . . 0.65 108.408 -169.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 40.0 t -69.77 -56.11 8.05 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 112.494 -2.139 . . . . 0.1 108.627 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.746 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.75 -36.9 85.81 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 113.381 -1.736 . . . . 0.04 109.284 -175.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.12 -33.84 76.71 Favored 'General case' 0 CA--C 1.491 -1.317 0 CA-C-N 113.275 -1.784 . . . . 0.07 110.182 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 119' ' ' THR . 48.4 m -76.2 -37.16 58.17 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 115.648 -0.705 . . . . 0.07 110.596 178.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.787 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.0 mt-30 -67.2 -40.47 86.5 Favored 'General case' 0 N--CA 1.41 -2.429 0 N-CA-C 109.351 -0.611 . . . . 0.09 109.351 -177.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.772 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.38 -47.6 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.31 0 C-N-CA 118.044 -1.463 . . . . 0.06 109.275 175.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.692 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.25 -33.58 53.61 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-O 121.043 0.449 . . . . 0.95 112.069 179.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.11 -49.1 71.29 Favored 'General case' 0 CA--C 1.477 -1.837 0 CA-C-N 115.122 -0.944 . . . . 0.05 110.059 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.764 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.7 mt -58.71 -44.22 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.663 0 CA-C-N 113.727 -1.578 . . . . 0.05 108.035 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.617 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.74 -50.53 73.46 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.176 -1.374 . . . . 0.09 108.639 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.579 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -49.72 -56.88 8.58 Favored 'General case' 0 CA--C 1.492 -1.276 0 O-C-N 125.133 1.521 . . . . 0.4 110.142 -178.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -39.83 33.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 115.232 -0.894 . . . . 0.05 110.273 -172.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.716 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.9 m-20 -57.98 -29.06 64.93 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 122.02 0.914 . . . . 0.09 109.92 171.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -72.9 -15.63 61.58 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.503 -1.681 . . . . 0.12 109.902 -176.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.697 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.7 mm-40 -86.95 -20.8 26.79 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.054 -1.43 . . . . 0.25 109.448 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.706 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.0 m-85 -95.71 157.06 16.06 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 121.876 0.846 . . . . 0.12 111.191 176.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 107' ' ' LYS . 12.9 mt-10 -57.92 -30.62 66.07 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 113.539 -1.664 . . . . 0.45 108.886 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 27.0 mmmt -146.73 146.0 24.99 Favored Pre-proline 0 CA--C 1.513 -0.468 0 N-CA-C 107.47 -1.307 . . . . 2.94 107.47 173.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.716 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 95.5 Cg_exo -45.11 138.99 8.87 Favored 'Trans proline' 0 CA--C 1.49 -1.698 0 C-N-CA 125.058 3.839 . . . . 0.14 113.703 -172.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.88 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -132.17 54.36 1.94 Allowed 'General case' 0 N--CA 1.41 -2.453 0 C-N-CA 117.223 -1.791 . . . . 0.06 111.641 171.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.764 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.86 98.06 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.927 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 19.6 m -131.26 114.57 26.58 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.103 -1.039 . . . . 0.14 109.927 -175.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.637 ' C ' HG21 ' A' ' 37' ' ' THR . 26.6 t70 75.4 39.51 0.36 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 113.568 -1.651 . . . . 0.53 109.528 -171.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.008 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 70.55 0.26 30.45 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.817 -0.629 . . . . 0.1 113.083 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.27 136.74 59.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.667 1.222 . . . . 0.15 110.343 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.88 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.32 152.18 46.16 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.868 -175.039 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.503 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.7 OUTLIER -102.23 93.49 5.24 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 113.702 -1.59 . . . . 0.48 106.913 174.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.773 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.9 p -68.51 -12.4 61.2 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 122.748 1.261 . . . . 0.2 110.082 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -76.87 -17.02 59.23 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 112.695 -2.048 . . . . 0.9 109.272 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -65.55 162.37 18.28 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 113.094 -1.867 . . . . 0.2 112.177 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.561 ' HB2' ' HG3' ' A' ' 93' ' ' GLU . 2.4 mppt? -125.13 92.95 3.74 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 112.166 -2.288 . . . . 1.99 108.849 -165.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.98 103.98 0.26 Allowed 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.066 -0.716 . . . . 0.13 109.066 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.633 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -48.1 164.38 0.05 Allowed 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 114.813 -1.085 . . . . 0.26 113.372 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.8 m -69.98 0.21 6.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.434 -0.803 . . . . 0.29 110.269 174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 109' ' ' LYS . 23.3 t70 -114.72 -16.72 11.76 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 114.655 -1.157 . . . . 1.51 109.118 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.697 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.69 116.03 0.98 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 122.766 1.27 . . . . 0.15 111.508 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -136.23 101.63 4.75 Favored 'General case' 0 C--N 1.294 -1.842 0 CA-C-N 112.564 -2.107 . . . . 2.22 107.914 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.7 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.6 m-85 -89.26 156.14 18.94 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.802 1.038 . . . . 0.15 113.802 -167.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.99 134.99 49.31 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 113.211 -1.813 . . . . 0.2 107.92 172.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.8 68.84 0.43 Allowed 'General case' 0 CA--C 1.502 -0.88 0 CA-C-O 122.168 0.985 . . . . 1.36 109.182 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.471 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.4 mt -70.19 120.89 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 113.577 -1.647 . . . . 0.18 111.941 -172.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -108.46 112.29 24.61 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 114.462 -1.244 . . . . 1.87 110.483 167.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' HA ' ' A' ' 81' ' ' GLN . 68.1 p -82.49 -17.75 44.07 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 112.802 -1.999 . . . . 0.16 108.695 176.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.44 -14.94 64.21 Favored Glycine 0 N--CA 1.425 -2.098 0 CA-C-N 114.247 -1.342 . . . . 0.18 111.117 -170.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.561 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 52.1 t30 -90.71 82.51 5.75 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 108.962 -0.755 . . . . 0.45 108.962 175.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.814 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.8 m -42.55 -57.92 2.48 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 113.943 1.09 . . . . 0.26 113.943 -169.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mt-10 -53.91 -36.05 62.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.706 0.289 . . . . 1.66 110.32 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.752 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.5 tp -70.87 -45.48 64.32 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.992 -0.744 . . . . 0.09 108.992 175.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.568 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.9 m-20 -56.43 -32.21 64.67 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.377 -0.829 . . . . 1.49 109.113 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.814 ' HG3' ' O ' ' A' ' 122' ' ' THR . 34.9 mtpt -79.55 -18.77 51.05 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.415 -1.266 . . . . 1.29 112.626 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.1 t -95.4 -29.53 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 109.102 -0.703 . . . . 0.09 109.102 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.4 mt -54.76 -48.27 72.82 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 106.437 -1.69 . . . . 0.07 106.437 170.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.31 -47.07 86.79 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.466 -3.061 . . . . 0.37 111.658 -179.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.634 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -44.94 -44.05 9.48 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 112.588 -2.096 . . . . 1.66 110.165 177.873 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.706 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.37 -52.07 25.2 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 113.86 -1.518 . . . . 0.06 109.916 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.7 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.85 -24.31 4.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.294 -0.866 . . . . 0.09 111.465 175.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 54.1 m -81.58 -16.38 51.79 Favored 'General case' 0 N--CA 1.416 -2.133 0 CA-C-N 115.279 -0.873 . . . . 1.33 110.264 -177.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -77.1 -27.69 54.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.028 -0.987 . . . . 0.1 108.583 167.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.845 0 CA-C-O 118.654 -1.081 . . . . 1.19 112.283 175.783 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.634 -0.586 . . . . 22.48 111.634 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -80.46 94.93 6.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.828 0.347 . . . . 23.33 110.151 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.7 ptp -115.02 -13.19 11.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 22.11 111.307 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.454 HE21 ' HA ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -155.56 132.44 10.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.585 0.231 . . . . 20.59 110.745 -174.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 16.3 m -123.34 -4.28 7.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.541 -0.3 . . . . 18.37 111.427 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.96 177.99 7.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.521 -0.309 . . . . 16.65 110.444 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.76 -50.12 63.75 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.197 -0.668 . . . . 17.53 109.197 178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.504 ' HB3' ' HA ' ' A' ' 11' ' ' GLU . 25.0 m 61.08 90.94 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.447 -0.797 . . . . 15.09 112.363 171.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.9 t -70.54 -24.01 62.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.463 -0.789 . . . . 13.75 110.648 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -153.27 25.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.723 -0.473 . . . . 14.58 109.723 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 8' ' ' SER . 2.8 mp0 66.09 158.55 0.12 Allowed 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.725 -0.671 . . . . 13.16 111.594 -176.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.7 mt -103.22 76.01 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.933 -0.576 . . . . 10.1 110.109 174.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -131.66 -60.23 0.94 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.778 -0.646 . . . . 10.66 110.16 177.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.0 t -100.3 -21.22 15.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.717 -0.674 . . . . 7.42 110.339 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.9 m -68.41 123.91 22.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 6.06 110.843 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -118.85 59.39 0.83 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.697 -0.482 . . . . 6.06 109.697 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.1 m 67.56 -79.8 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.565 -0.743 . . . . 2.91 111.118 -178.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.6 p -151.97 138.61 18.75 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.892 -0.781 . . . . 1.44 108.892 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 27.6 m -126.74 146.92 50.04 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.588 0.709 . . . . 1.25 111.531 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.72 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.35 -177.35 4.04 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 114.421 -1.263 . . . . 0.39 111.59 -177.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 12.1 m-80 -124.52 156.76 36.76 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.529 -1.669 . . . . 0.43 107.175 -174.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.581 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -77.31 -14.44 59.74 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.829 -0.748 . . . . 1.0 110.963 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.1 t -82.19 -9.17 59.6 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.866 -1.161 . . . . 1.36 107.866 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.647 ' HB3' HD13 ' A' ' 62' ' ' LEU . 67.6 m-20 -96.92 -46.98 6.01 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.456 -1.247 . . . . 1.27 108.657 174.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.581 ' HB ' HE21 ' A' ' 22' ' ' GLN . 54.8 t -86.41 -52.74 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-N 113.224 -1.807 . . . . 1.01 113.003 -165.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -57.59 -50.62 72.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.219 -0.446 . . . . 0.51 111.284 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.1 -37.83 88.76 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 109.762 -0.458 . . . . 0.45 109.762 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.573 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.4 t80 -54.23 -64.24 0.89 Allowed 'General case' 0 CA--C 1.497 -1.095 0 N-CA-C 108.019 -1.104 . . . . 0.13 108.019 174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.5 m-80 -61.6 -22.99 65.71 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.275 -1.784 . . . . 0.3 111.814 -174.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.7 m -86.25 -44.11 12.41 Favored 'General case' 0 N--CA 1.424 -1.772 0 CA-C-N 115.597 -0.729 . . . . 0.2 111.019 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.0 tp -71.06 -32.53 69.24 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 107.073 -1.454 . . . . 0.53 107.073 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 41.6 t80 -63.27 -45.48 91.27 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.198 -1.819 . . . . 0.15 110.183 173.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.4 OUTLIER -61.68 -29.21 69.94 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.879 1.323 . . . . 0.52 108.391 176.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.2 -31.38 49.4 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 111.83 -2.441 . . . . 0.1 112.417 -172.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.727 ' CG ' HD11 ' A' ' 78' ' ' LEU . 37.9 m-85 -63.71 -18.69 64.27 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 109.202 -0.666 . . . . 0.08 109.202 176.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 79.3 m-85 -96.18 129.37 43.5 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 114.997 -1.001 . . . . 0.11 109.581 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.716 HG21 ' C ' ' A' ' 99' ' ' ASP . 5.5 p -62.68 -23.69 67.25 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 113.542 -1.663 . . . . 0.17 110.234 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -135.51 157.61 46.46 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.867 -1.06 . . . . 1.52 108.747 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -77.74 -1.44 31.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.063 0.459 . . . . 0.36 110.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -73.17 -19.43 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.026 -0.731 . . . . 1.15 109.026 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.513 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.5 mtpt 53.95 42.21 31.76 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 114.051 -1.431 . . . . 0.66 110.647 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.551 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 44.4 p -109.55 -0.93 18.53 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 112.631 -2.077 . . . . 0.21 109.715 179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.077 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -152.85 146.76 25.3 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.491 -1.232 . . . . 0.1 109.268 -174.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.725 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.16 141.88 51.69 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 115.18 1.548 . . . . 0.09 115.18 -171.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 36.7 mttm -89.01 128.62 35.71 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 112.897 -1.956 . . . . 1.95 109.572 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.911 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.3 m120 -82.82 -24.58 33.26 Favored 'General case' 0 C--N 1.295 -1.803 0 CA-C-N 114.888 -1.051 . . . . 1.78 112.988 -169.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.3 m -74.15 -16.17 61.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.319 0.58 . . . . 1.32 110.096 177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 45' ' ' LYS . 8.7 mm100 -77.84 -22.23 50.24 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.952 -0.567 . . . . 0.82 110.865 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.545 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -57.16 -20.02 23.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.168 -0.469 . . . . 0.13 111.499 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -76.9 -25.73 53.35 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.194 0.997 . . . . 0.41 109.011 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -95.67 10.18 37.72 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 114.189 -1.369 . . . . 1.47 110.069 179.522 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.53 -38.72 84.62 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.438 -0.505 . . . . 0.09 110.311 177.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.2 t -68.5 -20.97 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.914 -0.773 . . . . 1.25 108.914 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.701 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -79.55 -37.66 35.98 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 115.187 -0.915 . . . . 1.24 110.26 175.302 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.573 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.44 -27.48 67.09 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 108.237 -1.023 . . . . 0.1 108.237 174.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.3 tptp -78.38 -26.74 46.66 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 114.287 -1.324 . . . . 0.82 108.606 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.701 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -75.49 -40.02 57.77 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 114.095 -1.411 . . . . 0.14 109.763 178.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -72.08 -40.09 68.49 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 115.243 -0.889 . . . . 0.16 110.25 176.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.628 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -61.4 -37.68 84.34 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.949 -0.76 . . . . 0.11 108.949 169.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.747 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.88 -21.93 66.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.832 0.825 . . . . 0.66 110.138 172.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 57' ' ' THR . 38.2 mttp -82.06 -17.62 46.03 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.065 -0.971 . . . . 1.92 110.211 174.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.68 -22.94 22.0 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.342 -1.299 . . . . 0.14 107.859 176.49 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.747 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -44.31 134.67 4.9 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 113.369 -1.742 . . . . 1.75 112.936 176.011 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.96 -16.87 34.99 Favored Glycine 0 N--CA 1.437 -1.257 0 CA-C-N 115.217 -0.901 . . . . 0.26 111.941 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.504 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 2.1 m -108.9 159.71 16.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.447 -0.575 . . . . 0.27 109.447 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 10.5 ptt180 -66.26 -25.68 66.99 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.15 0.5 . . . . 3.05 112.017 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.72 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.3 mm-40 -60.98 -38.66 86.78 Favored 'General case' 0 CA--C 1.493 -1.242 0 CA-C-N 115.347 -0.842 . . . . 2.51 109.6 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.668 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 31.4 t-80 -42.12 -44.34 3.62 Favored 'General case' 0 C--O 1.188 -2.176 0 CA-C-N 113.796 -1.547 . . . . 0.17 112.441 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.0 m -57.83 -53.42 58.42 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 123.017 1.389 . . . . 0.22 111.16 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.775 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.43 -44.32 83.19 Favored 'General case' 0 CA--C 1.476 -1.88 0 CA-C-N 111.674 -2.512 . . . . 0.21 107.238 -174.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.449 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.53 -21.22 38.69 Favored 'General case' 0 N--CA 1.406 -2.652 0 CA-C-N 111.747 -2.479 . . . . 0.11 110.91 -172.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.644 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 13.1 tttm -76.18 -34.89 59.32 Favored 'General case' 0 CA--C 1.473 -2.002 0 N-CA-C 106.327 -1.731 . . . . 1.35 106.327 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.6 t -74.14 -20.91 60.08 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 113.566 -1.652 . . . . 1.18 109.501 178.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.775 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.3 mtpp -82.87 -54.32 5.18 Favored 'General case' 0 CA--C 1.488 -1.431 0 CA-C-O 122.07 0.938 . . . . 1.02 109.833 171.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.515 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 16.0 t80 -51.21 -56.18 14.21 Favored 'General case' 0 N--CA 1.422 -1.836 0 CA-C-N 113.088 -1.869 . . . . 0.25 110.816 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.644 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -64.8 -33.38 75.86 Favored 'General case' 0 CA--C 1.498 -1.052 0 CA-C-O 122.682 1.23 . . . . 0.65 107.887 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.6 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.5 t -63.62 -55.37 24.15 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 112.311 -2.222 . . . . 0.1 108.446 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.727 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.22 -37.28 85.17 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 113.085 -1.871 . . . . 0.04 109.061 -175.635 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.31 -35.24 79.88 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 113.39 -1.732 . . . . 0.07 110.041 178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 119' ' ' THR . 31.0 m -73.46 -38.74 65.36 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.629 -0.714 . . . . 0.07 110.458 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.2 mt-30 -66.96 -40.24 87.45 Favored 'General case' 0 N--CA 1.41 -2.445 0 N-CA-C 109.404 -0.591 . . . . 0.09 109.404 -177.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.725 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.35 -47.07 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.386 0 C-N-CA 118.051 -1.459 . . . . 0.06 109.283 174.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.665 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.82 -31.85 59.67 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.143 0.497 . . . . 0.95 111.993 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.633 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.79 -49.27 68.9 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.16 -0.927 . . . . 0.05 110.047 173.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.785 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.0 mt -59.04 -44.57 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.622 -1.626 . . . . 0.05 108.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.623 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.34 -52.96 63.39 Favored 'General case' 0 N--CA 1.409 -2.524 0 CA-C-N 113.902 -1.499 . . . . 0.09 108.096 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.2 -58.21 4.31 Favored 'General case' 0 CA--C 1.492 -1.282 0 O-C-N 124.822 1.326 . . . . 0.4 110.042 -177.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -74.5 -41.23 49.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 CA-C-N 114.741 -1.118 . . . . 0.05 110.307 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.8 m-20 -58.01 -30.07 65.8 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.964 0.887 . . . . 0.09 110.09 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.06 -10.95 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.524 -1.671 . . . . 0.12 109.549 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.717 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.4 mm-40 -91.43 -18.59 23.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.17 -1.377 . . . . 0.25 109.528 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.713 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 32.7 m-85 -97.94 157.46 16.09 Favored 'General case' 0 CA--C 1.497 -1.065 0 CA-C-O 121.871 0.844 . . . . 0.12 111.576 176.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.707 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.8 mt-10 -62.06 -25.74 67.86 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 113.5 -1.682 . . . . 0.45 109.393 176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 30.8 mttp -146.58 144.72 21.23 Favored Pre-proline 0 CA--C 1.514 -0.415 0 N-CA-C 107.559 -1.274 . . . . 2.94 107.559 171.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 91.5 Cg_exo -46.58 138.69 14.13 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.611 3.541 . . . . 0.14 113.32 -174.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.889 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.24 53.75 1.96 Allowed 'General case' 0 N--CA 1.408 -2.53 0 C-N-CA 116.908 -1.917 . . . . 0.06 111.444 173.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.785 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.35 99.16 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.477 -1.847 0 N-CA-C 104.904 -2.258 . . . . 0.1 104.904 149.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.911 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 29.0 m -132.24 111.44 17.94 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.766 0 C-N-CA 119.023 -1.071 . . . . 0.14 110.358 -176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.716 ' C ' HG21 ' A' ' 37' ' ' THR . 17.1 t70 75.03 43.2 0.22 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.484 -1.689 . . . . 0.53 109.398 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.077 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.56 2.27 27.15 Favored Glycine 0 CA--C 1.501 -0.788 0 CA-C-N 115.421 -0.809 . . . . 0.1 113.118 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.84 134.8 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 CA-C-O 122.722 1.249 . . . . 0.15 110.575 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.889 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -66.55 152.04 46.07 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.735 -2.03 . . . . 0.11 111.4 -176.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.501 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -103.98 94.35 5.35 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 114.015 -1.448 . . . . 0.48 107.665 175.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.835 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -69.29 -9.65 54.2 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 122.51 1.147 . . . . 0.2 109.809 -178.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -85.54 -5.14 59.31 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 112.882 -1.963 . . . . 0.9 109.502 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.624 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.48 176.59 5.26 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.729 -1.578 . . . . 0.2 111.54 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.707 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.05 97.38 3.6 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.045 -1.434 . . . . 1.99 111.466 -169.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.567 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.86 101.77 0.53 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 109.014 -0.736 . . . . 0.13 109.014 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.661 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.67 166.09 0.02 OUTLIER 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.849 -177.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.0 m -73.51 0.55 12.17 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.002 -0.999 . . . . 0.29 110.254 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -119.56 -11.98 9.38 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 114.598 -1.183 . . . . 1.51 108.829 -175.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.717 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.28 121.83 4.12 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 122.565 1.174 . . . . 0.15 111.814 172.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -138.16 101.91 4.53 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.811 -1.995 . . . . 2.22 108.211 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.0 m-85 -89.73 158.65 17.45 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 113.768 1.025 . . . . 0.15 113.768 -169.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.16 139.47 47.07 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 113.325 -1.761 . . . . 0.2 107.906 174.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.16 67.33 0.3 Allowed 'General case' 0 CA--C 1.494 -1.207 0 CA-C-O 121.8 0.809 . . . . 1.36 109.205 175.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.488 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.2 mt -68.51 116.86 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.929 0 CA-C-N 113.955 -1.475 . . . . 0.18 111.633 -171.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -105.83 111.77 24.57 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.703 1.239 . . . . 1.87 110.405 168.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.778 HG21 ' HA ' ' A' ' 81' ' ' GLN . 73.2 p -81.97 -17.97 45.1 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 112.454 -2.157 . . . . 0.16 108.49 175.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.15 -16.04 61.47 Favored Glycine 0 N--CA 1.425 -2.093 0 CA-C-N 113.91 -1.496 . . . . 0.18 111.073 -169.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.556 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.6 t30 -90.73 84.81 5.9 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 109.508 -0.553 . . . . 0.45 109.508 176.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 25.3 m -42.75 -60.16 1.68 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 114.006 1.113 . . . . 0.26 114.006 -170.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.778 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.1 mt-10 -51.57 -38.28 53.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.712 0.291 . . . . 1.66 110.555 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.769 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.6 tp -69.29 -46.26 67.62 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 108.939 -0.764 . . . . 0.09 108.939 176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.8 m-20 -55.39 -32.58 62.75 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.204 0.94 . . . . 1.49 109.128 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 22.5 mtpp -78.59 -22.57 46.87 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.507 -1.224 . . . . 1.29 112.605 176.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 123' ' ' GLU . 42.0 t -92.9 -29.03 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.742 0.782 . . . . 0.09 109.096 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.769 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.6 mt -55.51 -48.6 74.38 Favored 'General case' 0 CA--C 1.499 -0.992 0 N-CA-C 106.37 -1.715 . . . . 0.07 106.37 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -59.16 -46.63 87.86 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 110.521 -3.036 . . . . 0.37 111.445 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.2 -45.69 8.54 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 112.351 -2.204 . . . . 1.66 109.988 177.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.713 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.45 -51.99 30.93 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.67 -1.604 . . . . 0.06 109.725 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.48 -25.59 5.06 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.196 -0.911 . . . . 0.09 111.538 176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 39.8 m -80.06 -14.43 58.54 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.201 -0.909 . . . . 1.33 110.172 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.835 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -81.2 -27.48 35.3 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.83 -1.077 . . . . 0.1 108.92 168.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.567 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.986 -0.897 . . . . 1.19 112.607 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.855 0 N-CA-C 112.308 -0.317 . . . . 22.48 112.308 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -83.75 138.01 33.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.844 0.355 . . . . 23.33 111.065 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.4 ttp -151.95 -61.14 0.16 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.959 -0.564 . . . . 22.11 109.784 178.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -164.72 127.75 2.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.368 -0.833 . . . . 20.59 108.768 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.0 t 67.38 90.46 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 O-C-N 123.788 0.68 . . . . 18.37 110.137 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.69 90.12 0.76 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.037 -0.529 . . . . 16.65 110.668 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -60.77 -40.78 93.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.626 -0.715 . . . . 17.53 110.585 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.1 p -86.08 61.85 7.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.063 -0.517 . . . . 15.09 109.712 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.6 m -58.53 97.14 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.631 -0.713 . . . . 13.75 112.022 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -95.26 -14.93 23.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.923 -0.58 . . . . 14.58 109.948 177.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -64.64 142.33 58.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.341 -0.845 . . . . 13.16 109.929 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -76.98 81.23 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.135 0.493 . . . . 10.1 110.25 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -137.15 156.7 48.02 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.684 -0.689 . . . . 10.66 109.384 177.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.3 p -116.98 134.4 54.79 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.696 0.284 . . . . 7.42 110.756 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.5 m -81.83 52.57 1.96 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.51 0.672 . . . . 6.06 110.391 178.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.54 135.99 38.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.279 -0.873 . . . . 6.06 109.542 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.9 m -73.55 166.39 23.34 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.368 . . . . 2.91 111.261 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 p -53.52 147.62 10.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.391 -0.822 . . . . 1.44 112.431 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.557 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 9.9 m -135.49 145.77 47.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.061 -0.518 . . . . 1.25 110.516 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -80.92 169.57 17.37 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 122.062 0.934 . . . . 0.39 111.351 -178.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.5 m-80 -108.64 142.52 39.0 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 113.506 -1.679 . . . . 0.43 106.88 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.607 HE21 HG22 ' A' ' 25' ' ' VAL . 1.1 mp0 -68.29 -13.0 61.94 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 119.21 0.914 . . . . 1.0 111.159 -178.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 p -79.52 -8.32 59.07 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.535 -0.913 . . . . 1.36 108.535 170.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HB3' HD13 ' A' ' 62' ' ' LEU . 79.0 m-20 -99.21 -47.42 5.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 114.421 -1.263 . . . . 1.27 108.421 176.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.607 HG22 HE21 ' A' ' 22' ' ' GLN . 1.6 m -92.86 -40.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-N 114.892 -1.049 . . . . 1.01 113.476 -166.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.9 t70 -59.85 -51.37 69.99 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.649 -0.25 . . . . 0.51 110.852 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.36 -36.75 84.94 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 109.477 -0.564 . . . . 0.45 109.477 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 70.7 t80 -53.88 -64.39 0.84 Allowed 'General case' 0 CA--C 1.497 -1.071 0 N-CA-C 108.085 -1.08 . . . . 0.13 108.085 174.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.642 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.1 m-80 -60.03 -27.54 67.0 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 113.357 -1.747 . . . . 0.3 111.323 -175.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.2 m -80.52 -47.08 14.78 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.285 -0.87 . . . . 0.2 110.916 -176.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.5 tp -69.83 -31.37 69.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 107.257 -1.386 . . . . 0.53 107.257 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.63 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 34.7 t80 -64.67 -47.17 79.42 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 113.055 -1.884 . . . . 0.15 110.377 175.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -22.0 66.93 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 122.346 1.069 . . . . 0.52 109.21 177.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -79.8 -33.82 40.12 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 112.891 -1.959 . . . . 0.1 111.559 -175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.0 m-85 -60.64 -22.44 63.83 Favored 'General case' 0 CA--C 1.487 -1.464 0 N-CA-C 108.999 -0.741 . . . . 0.08 108.999 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.585 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -93.5 127.28 39.08 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 114.405 -1.27 . . . . 0.11 109.126 177.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.626 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.3 p -62.74 -24.55 67.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.767 -1.56 . . . . 0.17 110.194 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.574 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 35.2 p-10 -139.32 155.31 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.139 -0.937 . . . . 1.52 108.715 -178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.8 p -76.03 -4.16 39.79 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.834 -0.346 . . . . 0.36 111.013 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.574 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 1.3 m-20 -72.4 -17.87 61.77 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.574 -0.898 . . . . 1.15 108.574 170.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.63 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 9.0 mtpt 54.58 40.96 32.2 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-N 114.266 -1.334 . . . . 0.66 110.63 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.462 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 43.7 p -107.34 3.1 25.0 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 112.914 -1.948 . . . . 0.21 109.791 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.983 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -156.0 148.3 23.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.309 -1.314 . . . . 0.1 109.454 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.754 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.32 139.48 53.26 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 114.608 1.336 . . . . 0.09 114.608 -172.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HG2' HG22 ' A' ' 37' ' ' THR . 12.3 mmtm -87.29 134.53 33.54 Favored 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 113.579 -1.646 . . . . 1.95 108.956 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.0 m120 -86.49 -25.07 25.32 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 114.425 -1.261 . . . . 1.78 111.679 -168.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 t -64.52 -29.3 70.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.784 -0.644 . . . . 1.32 109.886 174.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -71.43 -24.51 62.05 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.079 -0.509 . . . . 0.82 111.168 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.463 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.9 m-30 -56.22 -24.74 44.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.745 0.307 . . . . 0.13 111.63 -177.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -72.71 -20.01 61.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.792 0.805 . . . . 0.41 109.439 -179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.601 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 2.6 mmtt -98.74 7.75 45.73 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 114.341 -1.3 . . . . 1.47 110.408 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.68 -38.83 90.37 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 120.001 -0.68 . . . . 0.09 111.068 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -71.12 -17.62 62.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.611 0.72 . . . . 1.25 109.292 172.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.664 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 6.5 tt0 -80.89 -39.46 26.29 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.112 -0.949 . . . . 1.24 109.97 174.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.639 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.08 -29.47 69.81 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.064 -1.087 . . . . 0.1 108.064 174.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.605 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.31 -30.83 57.87 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.461 -1.245 . . . . 0.82 108.705 174.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.686 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.45 -39.21 77.92 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 114.84 -1.073 . . . . 0.14 109.497 177.804 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.771 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.16 -41.33 67.19 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.148 -0.933 . . . . 0.16 110.685 177.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.618 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.34 -35.65 81.08 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 109.192 -0.67 . . . . 0.11 109.192 170.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.69 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.76 -25.49 68.23 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.562 -0.745 . . . . 0.66 109.654 171.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.686 ' HG3' ' O ' ' A' ' 57' ' ' THR . 34.4 mtpt -78.7 -21.06 48.73 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.828 -1.078 . . . . 1.92 109.71 175.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.771 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -88.02 -23.86 23.67 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 114.01 -1.45 . . . . 0.14 107.885 178.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.69 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.1 mt-10 -46.18 125.78 6.96 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 113.606 -1.634 . . . . 1.75 112.039 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -13.37 67.72 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.632 -0.795 . . . . 0.26 111.826 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.478 ' HB3' ' C ' ' A' ' 19' ' ' THR . 0.8 OUTLIER -109.06 165.21 11.76 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.55 -0.537 . . . . 0.27 109.55 -179.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.557 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 18.0 ptp180 -70.1 -28.29 65.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.148 0.499 . . . . 3.05 111.864 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.648 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.8 tm-20 -59.89 -37.87 80.61 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-N 115.29 -0.868 . . . . 2.51 108.975 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.647 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 29.4 t-80 -41.85 -46.52 3.98 Favored 'General case' 0 C--O 1.191 -1.993 0 CA-C-N 113.185 -1.825 . . . . 0.17 113.029 177.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.9 m -55.87 -52.17 65.01 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-O 123.29 1.519 . . . . 0.22 110.922 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.834 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -66.48 -44.34 82.93 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 111.345 -2.661 . . . . 0.21 107.291 -174.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.445 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.91 -21.48 37.32 Favored 'General case' 0 C--N 1.271 -2.834 0 CA-C-N 111.942 -2.39 . . . . 0.11 111.197 -172.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 22.0 tttp -76.18 -36.3 58.75 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.483 -1.673 . . . . 1.35 106.483 172.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.7 p -78.53 -12.22 60.0 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.069 -1.423 . . . . 1.18 110.089 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.834 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.4 mtpp -85.71 -55.96 3.73 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 122.115 0.96 . . . . 1.02 109.893 167.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.438 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.5 t80 -51.79 -57.26 9.82 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.229 -1.805 . . . . 0.25 111.119 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.659 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.3 -29.25 69.42 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 122.623 1.202 . . . . 0.65 108.006 -169.169 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.6 t -67.77 -56.12 10.44 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 112.426 -2.17 . . . . 0.1 108.617 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.89 -37.27 87.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 113.203 -1.817 . . . . 0.04 109.137 -176.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.89 -34.96 79.33 Favored 'General case' 0 CA--C 1.49 -1.354 0 CA-C-N 113.333 -1.758 . . . . 0.07 109.823 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.494 HG22 HG22 ' A' ' 119' ' ' THR . 40.5 m -73.81 -38.05 64.71 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.598 -0.728 . . . . 0.07 110.743 178.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.766 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.0 -40.08 87.27 Favored 'General case' 0 N--CA 1.411 -2.378 0 N-CA-C 109.222 -0.659 . . . . 0.09 109.222 -177.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.754 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.77 -47.33 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 C-N-CA 118.129 -1.428 . . . . 0.06 109.344 174.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.04 -30.22 59.1 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.252 0.549 . . . . 0.95 112.14 179.617 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -67.03 -49.42 65.31 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 114.999 -1.0 . . . . 0.05 110.076 172.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.784 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.9 mt -59.02 -44.19 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.601 0 CA-C-N 113.527 -1.67 . . . . 0.05 108.053 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.632 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.45 -51.84 68.16 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 114.03 -1.441 . . . . 0.09 108.25 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -46.51 -58.89 3.36 Favored 'General case' 0 CA--C 1.491 -1.309 0 O-C-N 124.858 1.349 . . . . 0.4 109.88 -178.591 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.623 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.9 -40.52 45.95 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 CA-C-N 114.578 -1.192 . . . . 0.05 110.356 -172.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.696 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.8 m-20 -59.37 -28.27 66.71 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.909 0.861 . . . . 0.09 110.154 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -75.83 -11.68 60.02 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 113.808 -1.542 . . . . 0.12 109.516 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.72 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.0 mm-40 -89.63 -20.41 23.73 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.294 -1.321 . . . . 0.25 109.305 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.703 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 28.2 m-85 -96.75 158.23 15.53 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 122.067 0.937 . . . . 0.12 111.53 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.706 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.8 mt-10 -62.85 -25.68 68.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 113.487 -1.688 . . . . 0.45 109.186 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -147.08 143.39 18.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-N 114.391 -1.277 . . . . 2.94 108.834 173.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.696 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 79.7 Cg_exo -47.9 137.11 22.45 Favored 'Trans proline' 0 CA--C 1.487 -1.874 0 C-N-CA 124.309 3.34 . . . . 0.14 113.286 -173.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.888 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.88 53.82 1.95 Allowed 'General case' 0 N--CA 1.408 -2.565 0 C-N-CA 117.162 -1.815 . . . . 0.06 111.406 173.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.784 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.3 98.35 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 104.881 -2.266 . . . . 0.1 104.881 149.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.1 m -131.16 113.6 24.35 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 C-N-CA 118.908 -1.117 . . . . 0.14 110.134 -176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.626 ' C ' HG21 ' A' ' 37' ' ' THR . 38.1 t70 75.71 39.45 0.33 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.662 -1.608 . . . . 0.53 109.564 -171.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.983 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.85 2.68 39.02 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.517 -0.765 . . . . 0.1 112.981 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.94 135.51 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 CA-C-O 122.461 1.124 . . . . 0.15 110.41 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.888 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.41 153.24 44.14 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 113.268 -1.787 . . . . 0.11 112.018 -175.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.507 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -105.75 94.49 5.22 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.011 -1.45 . . . . 0.48 107.469 175.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -68.47 -11.98 60.56 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.502 1.144 . . . . 0.2 109.984 -177.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -87.36 0.92 54.74 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.127 -1.851 . . . . 0.9 109.511 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.64 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.58 177.99 4.36 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 113.831 -1.531 . . . . 0.2 111.135 177.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.706 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.2 mmmt -136.6 94.38 2.99 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 114.23 -1.35 . . . . 1.99 111.346 -170.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.3 99.04 0.17 Allowed 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.197 -0.668 . . . . 0.13 109.197 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.582 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.1 mtmt -45.17 165.27 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 114.647 -1.161 . . . . 0.26 113.701 -176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.8 m -72.36 0.56 9.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.412 -0.813 . . . . 0.29 110.38 173.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.55 -13.64 12.16 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 114.993 -1.003 . . . . 1.51 109.403 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.72 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -48.0 113.85 0.81 Allowed 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 122.391 1.091 . . . . 0.15 111.77 175.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.0 tttp -133.14 101.62 5.28 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 112.827 -1.988 . . . . 2.22 108.097 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.15 155.03 19.68 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 122.232 1.015 . . . . 0.15 113.726 -168.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.2 p -128.75 135.44 49.19 Favored 'General case' 0 N--CA 1.434 -1.275 0 CA-C-N 113.077 -1.874 . . . . 0.2 107.741 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.3 65.9 0.63 Allowed 'General case' 0 CA--C 1.502 -0.878 0 CA-C-O 122.02 0.914 . . . . 1.36 109.49 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.485 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -66.49 121.97 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 CA-C-N 113.44 -1.709 . . . . 0.18 112.185 -170.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -108.79 109.04 20.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 114.472 -1.24 . . . . 1.87 110.53 168.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 81' ' ' GLN . 60.3 p -79.63 -17.63 53.34 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.563 -2.108 . . . . 0.16 108.718 175.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.45 -19.58 54.12 Favored Glycine 0 N--CA 1.427 -1.965 0 CA-C-N 114.186 -1.37 . . . . 0.18 111.012 -169.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 47.8 t30 -88.94 91.0 8.66 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 107.817 -1.179 . . . . 0.45 107.817 173.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.859 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.5 m -50.76 -56.88 9.99 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 115.2 -0.909 . . . . 0.26 113.19 -173.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.797 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.5 OUTLIER -53.0 -35.29 59.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.791 0.329 . . . . 1.66 110.353 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.748 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.9 tp -71.88 -46.16 58.82 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.636 -0.711 . . . . 0.09 109.093 176.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.582 ' HA ' HD12 ' A' ' 128' ' ' LEU . 99.4 m-20 -57.03 -31.07 64.77 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.219 -0.9 . . . . 1.49 109.22 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.859 ' HG3' ' O ' ' A' ' 122' ' ' THR . 36.8 mtpt -79.67 -19.16 49.7 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.805 -1.089 . . . . 1.29 112.302 175.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 123' ' ' GLU . 45.0 t -95.09 -29.53 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.832 0 N-CA-C 108.938 -0.764 . . . . 0.09 108.938 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 58.4 mt -55.15 -48.5 73.64 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 106.441 -1.689 . . . . 0.07 106.441 171.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER -58.15 -47.03 84.6 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 110.587 -3.006 . . . . 0.37 111.744 -179.691 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.651 ' HB3' HD22 ' A' ' 102' ' ' LEU . 2.8 mptt -45.42 -44.43 12.1 Favored 'General case' 0 CA--C 1.493 -1.235 0 CA-C-N 112.293 -2.231 . . . . 1.66 110.143 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.703 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.56 -51.48 35.02 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 113.872 -1.513 . . . . 0.06 109.807 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.43 -23.41 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 CA-C-N 115.155 -0.93 . . . . 0.09 111.455 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 16.0 t -84.35 -12.93 53.66 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.152 -0.931 . . . . 1.33 109.759 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -78.85 -31.9 45.83 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.867 -1.06 . . . . 0.1 108.302 166.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.798 -1.001 . . . . 1.19 112.179 177.076 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.946 -0.461 . . . . 22.48 111.946 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 58.29 48.79 12.02 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.51 0.671 . . . . 23.33 110.356 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.483 ' CE ' ' HA ' ' A' ' 3' ' ' MET . 0.9 OUTLIER -116.77 68.7 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.741 -0.663 . . . . 22.11 109.953 176.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.22 110.67 6.83 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.164 -0.925 . . . . 20.59 109.229 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' A' ' 8' ' ' SER . 9.3 m -82.95 96.24 3.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.631 0.729 . . . . 18.37 111.068 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.88 -22.84 15.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.551 -0.749 . . . . 16.65 110.749 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 2.7 tmt_? -83.89 -39.84 19.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.323 -0.621 . . . . 17.53 109.323 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 5' ' ' VAL . 7.0 p -119.2 141.47 48.86 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.491 -0.777 . . . . 15.09 110.796 -178.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.5 m 72.43 -77.77 0.05 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.188 -0.46 . . . . 13.75 111.895 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? 53.84 52.09 13.66 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.054 0.542 . . . . 14.58 111.204 -177.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -99.75 145.85 27.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.961 0.41 . . . . 13.16 111.266 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.5 mt -95.31 89.7 2.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.061 -0.518 . . . . 10.1 110.333 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -125.43 173.28 8.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.248 0.547 . . . . 10.66 111.379 -176.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 p -112.11 83.83 1.86 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.258 -0.883 . . . . 7.42 110.876 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 23.4 m -71.39 94.54 1.25 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.807 -0.633 . . . . 6.06 111.012 -177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -163.18 -72.33 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.777 -0.647 . . . . 6.06 110.19 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m -156.78 -168.61 2.72 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.933 -0.576 . . . . 2.91 109.562 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.416 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 24.5 p -62.01 -73.58 0.1 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.469 0.652 . . . . 1.44 109.725 171.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.623 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.1 m 63.39 146.66 0.02 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.927 -1.488 . . . . 1.25 113.309 173.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.73 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -91.96 -172.93 3.32 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.352 -1.294 . . . . 0.39 112.175 -175.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.525 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 14.7 m-80 -128.86 158.35 38.99 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.328 -1.76 . . . . 0.43 107.097 -174.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.608 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -79.8 -14.62 58.57 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 118.849 0.75 . . . . 1.0 111.592 -176.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.8 m -81.34 -9.54 59.73 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 108.036 -1.098 . . . . 1.36 108.036 170.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.584 ' HB3' HD13 ' A' ' 62' ' ' LEU . 80.2 m-20 -98.47 -43.66 6.8 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.058 -1.428 . . . . 1.27 109.305 176.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.608 ' HB ' HE21 ' A' ' 22' ' ' GLN . 78.7 t -91.06 -54.21 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 113.986 -1.461 . . . . 1.01 112.928 -168.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.463 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 12.0 t70 -52.87 -53.41 49.34 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.015 -0.538 . . . . 0.51 111.548 -175.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -66.47 -36.78 83.6 Favored 'General case' 0 CA--C 1.498 -1.051 0 N-CA-C 110.129 -0.322 . . . . 0.45 110.129 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.619 ' CE1' HD13 ' A' ' 55' ' ' LEU . 73.2 t80 -54.09 -63.89 1.0 Allowed 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 107.817 -1.179 . . . . 0.13 107.817 174.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.629 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -60.69 -29.39 69.29 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 113.342 -1.754 . . . . 0.3 111.643 -175.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -78.29 -46.68 19.61 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.624 -0.716 . . . . 0.2 111.156 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.689 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.3 tp -68.72 -33.04 73.26 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 107.234 -1.395 . . . . 0.53 107.234 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.9 t80 -63.7 -48.18 78.18 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 112.814 -1.994 . . . . 0.15 110.76 176.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.33 -24.8 67.78 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.406 1.098 . . . . 0.52 108.956 178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -76.49 -33.69 58.65 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 112.714 -2.039 . . . . 0.1 111.587 -175.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 78' ' ' LEU . 38.2 m-85 -60.7 -22.9 64.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 N-CA-C 108.913 -0.773 . . . . 0.08 108.913 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.627 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.9 m-85 -94.01 126.75 39.4 Favored 'General case' 0 N--CA 1.42 -1.932 0 CA-C-N 114.291 -1.322 . . . . 0.11 109.314 178.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.681 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.4 p -62.61 -24.88 67.8 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 113.587 -1.642 . . . . 0.17 110.36 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.9 p30 -135.61 156.03 49.51 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.174 -0.921 . . . . 1.52 108.63 178.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 11.9 p -78.42 2.79 17.66 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.44 -0.504 . . . . 0.36 110.589 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -76.05 -18.24 59.31 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.725 -0.842 . . . . 1.15 108.725 169.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 53.85 42.34 31.77 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.187 -1.369 . . . . 0.66 110.679 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.486 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 47.1 p -108.28 0.79 21.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 112.637 -2.074 . . . . 0.21 109.596 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.009 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.91 147.08 23.75 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.479 -1.237 . . . . 0.1 109.541 -172.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.33 138.74 53.61 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 114.682 1.364 . . . . 0.09 114.682 -172.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.486 ' HG2' HG22 ' A' ' 37' ' ' THR . 22.3 mmtt -87.96 132.86 34.08 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-N 113.467 -1.697 . . . . 1.95 109.603 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.4 OUTLIER -80.06 -26.51 39.62 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.704 -1.135 . . . . 1.78 111.966 -171.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -64.26 -26.31 68.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.318 0.58 . . . . 1.32 110.449 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.561 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.2 mm100 -75.35 -24.5 57.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.67 -0.696 . . . . 0.82 111.52 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.509 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -56.81 -21.88 32.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.803 0.335 . . . . 0.13 111.567 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -74.57 -21.49 59.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.166 0.984 . . . . 0.41 109.248 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.62 ' CD ' HD11 ' A' ' 31' ' ' LEU . 2.0 mttt -100.79 10.53 41.02 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 113.998 -1.455 . . . . 1.47 110.183 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.627 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.1 OUTLIER -69.09 -40.1 78.6 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.277 -0.569 . . . . 0.09 110.732 178.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 64.6 m -68.42 -17.98 64.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.624 0.726 . . . . 1.25 109.272 171.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -81.55 -37.21 28.12 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-N 115.122 -0.945 . . . . 1.24 110.03 173.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.619 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.41 -26.13 66.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.492 -0.929 . . . . 0.1 108.492 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.7 OUTLIER -80.51 -24.32 39.47 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 114.752 -1.113 . . . . 0.82 108.779 173.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.7 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -77.62 -39.11 46.41 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.804 -1.544 . . . . 0.14 109.609 178.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.784 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.8 mt -73.06 -39.55 65.81 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 115.21 -0.905 . . . . 0.16 110.049 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.62 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -62.88 -35.81 81.25 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.391 -0.596 . . . . 0.11 109.391 169.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.772 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 1.8 t70 -59.79 -28.21 67.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 122.131 0.967 . . . . 0.66 109.522 170.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.7 ' HG3' ' O ' ' A' ' 57' ' ' THR . 52.2 mttm -78.96 -16.74 56.54 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.616 -1.175 . . . . 1.92 109.748 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.784 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -92.0 -21.91 20.26 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.099 -1.41 . . . . 0.14 107.835 175.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.772 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 15.2 mt-10 -50.19 126.74 15.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.117 -1.402 . . . . 1.75 111.346 175.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.12 -7.14 78.79 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.591 -0.814 . . . . 0.26 111.338 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.623 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.6 m -110.32 172.56 6.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.704 -0.48 . . . . 0.27 109.704 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 0.2 OUTLIER -82.02 -27.76 32.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.423 0.63 . . . . 3.05 110.246 177.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.73 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.0 mp0 -59.01 -35.87 73.98 Favored 'General case' 0 CA--C 1.488 -1.409 0 CA-C-N 114.96 -1.018 . . . . 2.51 110.575 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.698 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 26.8 t-80 -40.4 -46.93 2.49 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-N 113.41 -1.723 . . . . 0.17 112.696 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -55.8 -53.54 55.44 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-O 123.152 1.453 . . . . 0.22 111.056 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.819 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.77 -44.45 89.99 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-N 111.558 -2.565 . . . . 0.21 107.453 -174.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.458 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.75 -22.2 37.39 Favored 'General case' 0 N--CA 1.407 -2.584 0 CA-C-N 111.812 -2.449 . . . . 0.11 111.061 -172.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 11.8 tttm -76.4 -34.09 58.84 Favored 'General case' 0 CA--C 1.475 -1.925 0 N-CA-C 106.164 -1.791 . . . . 1.35 106.164 172.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 77' ' ' SER . 47.8 t -75.19 -19.23 59.92 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.688 -1.597 . . . . 1.18 109.699 177.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.819 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.6 mtpp -83.29 -55.23 4.45 Favored 'General case' 0 CA--C 1.488 -1.419 0 CA-C-O 122.14 0.971 . . . . 1.02 109.502 171.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.414 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.55 -56.01 15.89 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 112.992 -1.913 . . . . 0.25 110.98 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.36 -35.05 79.11 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 122.971 1.367 . . . . 0.65 108.099 -170.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.613 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.4 t -63.08 -56.47 16.59 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 111.781 -2.463 . . . . 0.1 108.365 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.756 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.07 -36.64 83.76 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 112.991 -1.913 . . . . 0.04 109.19 -175.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.57 -35.2 79.63 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-N 113.381 -1.736 . . . . 0.07 110.059 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.437 HG22 HG22 ' A' ' 119' ' ' THR . 52.6 m -75.78 -37.5 59.14 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 115.435 -0.802 . . . . 0.07 110.555 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.705 ' HA ' HG21 ' A' ' 119' ' ' THR . 41.7 mt-30 -66.69 -40.28 88.46 Favored 'General case' 0 N--CA 1.408 -2.551 0 N-CA-C 109.216 -0.661 . . . . 0.09 109.216 -178.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.28 -49.11 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.378 0 C-N-CA 117.951 -1.5 . . . . 0.06 109.489 174.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.5 mptt -51.97 -33.13 36.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 112.566 0.58 . . . . 0.95 112.566 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.63 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.97 -49.19 68.74 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 115.198 -0.91 . . . . 0.05 110.15 173.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.801 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.1 mt -58.44 -45.42 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.642 0 CA-C-N 113.488 -1.687 . . . . 0.05 107.963 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.6 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.54 -51.76 68.51 Favored 'General case' 0 N--CA 1.408 -2.541 0 CA-C-N 114.16 -1.382 . . . . 0.09 108.366 179.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -47.51 -57.33 5.52 Favored 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.003 1.439 . . . . 0.4 110.089 -177.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.25 -40.13 35.73 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 CA-C-N 115.084 -0.962 . . . . 0.05 110.334 -173.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.721 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.1 m-20 -57.83 -30.37 65.7 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.12 0.962 . . . . 0.09 110.163 172.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.04 -12.52 60.65 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.333 -1.758 . . . . 0.12 109.522 -175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.733 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -89.26 -18.92 26.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 114.181 -1.372 . . . . 0.25 109.41 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.709 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.9 m-85 -96.58 159.48 14.91 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.992 0.901 . . . . 0.12 111.628 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.717 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.0 mt-10 -63.26 -24.77 68.02 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.347 -1.751 . . . . 0.45 109.136 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -150.77 145.13 17.94 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 114.553 -1.203 . . . . 2.94 109.568 169.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.721 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.1 Cg_exo -44.02 137.29 7.16 Favored 'Trans proline' 0 CA--C 1.486 -1.903 0 C-N-CA 124.687 3.592 . . . . 0.14 113.462 -172.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.875 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.96 53.86 1.95 Allowed 'General case' 0 N--CA 1.408 -2.571 0 C-N-CA 117.126 -1.83 . . . . 0.06 111.345 173.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.801 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.45 98.07 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.9 0 N-CA-C 104.865 -2.272 . . . . 0.1 104.865 149.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 26.9 m -133.35 113.28 18.9 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.865 0 C-N-CA 119.246 -0.982 . . . . 0.14 109.207 -176.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.681 ' C ' HG21 ' A' ' 37' ' ' THR . 38.9 t70 78.08 39.19 0.16 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.1 -1.409 . . . . 0.53 109.502 -171.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.009 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.92 4.39 27.15 Favored Glycine 0 CA--C 1.502 -0.754 0 CA-C-N 115.366 -0.834 . . . . 0.1 112.773 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.91 136.85 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.613 0 CA-C-O 122.601 1.191 . . . . 0.15 110.179 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.875 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.48 152.13 46.2 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 112.904 -1.953 . . . . 0.11 111.734 -176.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.532 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.7 t70 -101.81 93.11 5.14 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 106.771 -1.566 . . . . 0.48 106.771 175.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.825 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.4 p -68.56 -12.8 61.78 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 122.866 1.317 . . . . 0.2 109.58 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.458 ' HB3' ' OD2' ' A' ' 103' ' ' ASP . 62.9 t30 -87.76 0.3 55.94 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 112.461 -2.154 . . . . 0.9 109.517 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.625 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.0 177.17 6.54 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 113.653 -1.612 . . . . 0.2 111.087 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.717 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.1 mmmt -136.42 94.68 3.05 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.018 -1.447 . . . . 1.99 111.122 -170.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -61.69 103.03 0.3 Allowed 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.794 -0.817 . . . . 0.13 108.794 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 44.1 mtmt -46.88 163.3 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.829 -1.078 . . . . 0.26 112.837 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.7 m -71.95 0.34 9.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.617 0.722 . . . . 0.29 110.479 174.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -118.27 -9.31 10.45 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.896 -1.047 . . . . 1.51 108.91 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.733 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.62 118.71 2.37 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 122.402 1.096 . . . . 0.15 111.4 170.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -135.95 100.43 4.44 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.97 -1.923 . . . . 2.22 108.397 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.688 ' CG ' HG23 ' A' ' 132' ' ' ILE . 85.0 m-85 -89.32 154.43 20.09 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 114.252 1.205 . . . . 0.15 114.252 -167.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.81 134.63 49.47 Favored 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 112.994 -1.912 . . . . 0.2 108.035 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -72.04 69.06 0.72 Allowed 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 122.015 0.912 . . . . 1.36 108.937 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.48 HG21 ' CB ' ' A' ' 84' ' ' ALA . 16.1 mt -68.2 122.35 19.25 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 CA-C-N 113.435 -1.711 . . . . 0.18 112.539 -170.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -103.58 110.34 22.35 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 114.313 -1.312 . . . . 1.87 111.415 168.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.705 HG21 ' HA ' ' A' ' 81' ' ' GLN . 67.7 p -84.92 -19.1 32.76 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 113.063 -1.88 . . . . 0.16 108.571 174.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.14 -14.68 64.83 Favored Glycine 0 N--CA 1.426 -1.973 0 CA-C-N 114.24 -1.345 . . . . 0.18 111.325 -170.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 51.3 t30 -92.84 85.56 5.22 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 109.528 -0.545 . . . . 0.45 109.528 176.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.827 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.3 m -44.81 -58.9 2.81 Favored 'General case' 0 C--O 1.214 -0.811 0 N-CA-C 113.889 1.07 . . . . 0.26 113.889 -169.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.96 -35.53 59.01 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.179 0.299 . . . . 1.66 110.372 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.766 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.4 tp -71.18 -46.59 61.02 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 109.156 -0.683 . . . . 0.09 109.156 175.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.9 m-20 -52.93 -34.75 56.73 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.591 -0.892 . . . . 1.49 108.591 178.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.827 ' HG3' ' O ' ' A' ' 122' ' ' THR . 21.8 mtpp -76.54 -24.67 53.62 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.47 -1.241 . . . . 1.29 112.595 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 123' ' ' GLU . 41.4 t -91.47 -28.92 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.826 -0.805 . . . . 0.09 108.826 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.766 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -55.15 -49.06 72.76 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 106.289 -1.745 . . . . 0.07 106.289 171.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -58.12 -47.79 82.21 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 110.532 -3.031 . . . . 0.37 111.483 -179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.665 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.38 -44.82 8.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 112.534 -2.121 . . . . 1.66 110.052 177.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.709 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.9 -51.82 29.83 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 113.861 -1.518 . . . . 0.06 109.915 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.688 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.84 -24.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 115.158 -0.928 . . . . 0.09 111.457 176.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.7 m -82.43 -14.6 54.87 Favored 'General case' 0 N--CA 1.415 -2.177 0 CA-C-N 114.939 -1.028 . . . . 1.33 110.115 -177.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.2 mp -80.6 -29.94 36.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.809 -1.087 . . . . 0.1 108.335 166.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.251 1.189 0 CA-C-O 118.494 -1.17 . . . . 1.19 112.777 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.847 0 N-CA-C 112.145 -0.382 . . . . 22.48 112.145 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -63.19 123.73 19.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.665 0.269 . . . . 23.33 110.633 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.9 ptp -104.46 153.75 20.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.304 0.574 . . . . 22.11 111.104 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -90.22 132.69 35.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.182 -0.917 . . . . 20.59 108.803 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.8 p -57.55 -37.48 58.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-O 120.932 0.396 . . . . 18.37 110.705 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.74 80.29 7.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.247 -0.649 . . . . 16.65 109.247 171.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 75.5 mtm180 -55.42 -49.93 71.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.501 -0.772 . . . . 17.53 110.991 -176.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.419 ' O ' ' HB ' ' A' ' 9' ' ' THR . 4.4 p -92.66 9.99 32.5 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.636 -0.711 . . . . 15.09 110.928 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 8' ' ' SER . 74.6 m 69.37 -70.87 0.13 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 115.812 -0.631 . . . . 13.75 110.886 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -140.48 -78.4 0.3 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.161 -0.681 . . . . 14.58 109.161 177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 57.16 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.708 0.766 . . . . 13.16 112.402 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.25 98.18 6.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.505 -0.77 . . . . 10.1 110.068 176.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.28 1.66 6.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.922 0.391 . . . . 10.66 111.206 -177.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 15' ' ' SER . 0.8 OUTLIER -97.39 -178.05 4.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.684 -0.487 . . . . 7.42 109.684 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 14' ' ' THR . 38.3 t -56.74 -36.4 69.7 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 109.614 -0.513 . . . . 6.06 109.614 172.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' HB3' ' O ' ' A' ' 15' ' ' SER . 47.8 tt0 74.56 -52.81 0.68 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.165 -0.925 . . . . 6.06 111.254 176.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 m -107.48 178.27 4.59 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.024 0.44 . . . . 2.91 110.222 175.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.8 p -88.11 136.92 32.75 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.497 -0.774 . . . . 1.44 111.527 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.431 ' C ' ' HB3' ' A' ' 65' ' ' SER . 4.0 m -127.85 144.68 51.09 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.899 -0.591 . . . . 1.25 110.658 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.741 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -73.36 -176.96 2.4 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.219 1.009 . . . . 0.39 111.497 -177.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.9 m-80 -128.3 149.52 50.46 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.589 -1.641 . . . . 0.43 106.86 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.606 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -74.18 -12.84 60.69 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.824 -0.75 . . . . 1.0 111.532 -177.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.1 m -82.12 -10.8 59.06 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 108.352 -0.981 . . . . 1.36 108.352 171.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.622 ' HB3' HD13 ' A' ' 62' ' ' LEU . 76.8 m-20 -97.04 -46.09 6.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.268 -1.333 . . . . 1.27 108.821 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.606 ' HB ' HE21 ' A' ' 22' ' ' GLN . 59.1 t -84.47 -52.57 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 CA-C-N 113.281 -1.781 . . . . 1.01 112.776 -167.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -53.34 -56.22 18.47 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 123.657 0.598 . . . . 0.51 111.18 -175.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -63.54 -37.97 89.33 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 109.779 -0.452 . . . . 0.45 109.779 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.671 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t80 -54.25 -64.91 0.68 Allowed 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 108.14 -1.059 . . . . 0.13 108.14 175.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.539 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -62.99 -24.39 67.89 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-N 113.191 -1.822 . . . . 0.3 111.551 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 18.3 m -82.53 -47.74 11.82 Favored 'General case' 0 N--CA 1.423 -1.798 0 CA-C-N 115.104 -0.953 . . . . 0.2 111.17 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 12.6 tp -67.57 -33.2 74.54 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 106.92 -1.511 . . . . 0.53 106.92 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.714 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.2 t80 -64.37 -46.01 85.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 112.885 -1.961 . . . . 0.15 110.475 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 0.5 OUTLIER -59.58 -33.67 71.75 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-O 123.077 1.418 . . . . 0.52 107.56 177.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -72.25 -34.57 68.36 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 111.748 -2.478 . . . . 0.1 112.386 -172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.748 ' CG ' HD11 ' A' ' 78' ' ' LEU . 40.4 m-85 -61.51 -22.77 65.41 Favored 'General case' 0 CA--C 1.491 -1.32 0 CA-C-O 121.507 0.67 . . . . 0.08 109.5 177.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.662 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 93.1 m-85 -94.87 128.26 41.5 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.834 -1.075 . . . . 0.11 109.013 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.708 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.6 p -63.81 -26.95 68.86 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.67 -1.604 . . . . 0.17 109.561 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.57 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 33.4 p-10 -140.08 153.82 46.86 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.868 -1.06 . . . . 1.52 109.038 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -76.34 -7.54 55.2 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.14 -0.35 . . . . 0.36 111.841 -176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.57 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 5.0 m-20 -68.33 -18.37 64.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.812 -0.81 . . . . 1.15 108.812 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.58 ' HG2' ' CG ' ' A' ' 36' ' ' TYR . 33.8 mttp 53.95 43.98 30.05 Favored 'General case' 0 CA--C 1.5 -0.978 0 CA-C-N 114.139 -1.392 . . . . 0.66 111.058 175.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 45.5 p -107.1 6.09 28.54 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 112.319 -2.219 . . . . 0.21 109.466 179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.033 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 144.8 17.32 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.181 -1.372 . . . . 0.1 109.728 -173.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.734 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -126.26 142.49 51.51 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.473 1.286 . . . . 0.09 114.473 -173.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.586 ' HG3' HG22 ' A' ' 37' ' ' THR . 64.4 mttt -88.75 121.01 30.67 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 113.234 -1.803 . . . . 1.95 109.94 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.885 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 13.4 m-80 -72.61 -22.23 61.0 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.422 -0.808 . . . . 1.78 112.111 -174.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.1 p -66.69 -28.75 68.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.567 0.699 . . . . 1.32 110.598 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.3 mm100 -76.81 -22.15 54.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.025 -0.989 . . . . 0.82 111.508 -177.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.595 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -56.55 -22.3 32.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.875 0.369 . . . . 0.13 111.827 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -72.93 -25.23 60.96 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.188 0.994 . . . . 0.41 108.983 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.637 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.7 mttt -97.08 9.74 41.25 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 113.872 -1.513 . . . . 1.47 109.962 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.664 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -67.47 -40.49 85.32 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.557 -0.457 . . . . 0.09 110.352 177.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.9 m -65.97 -23.62 66.63 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.947 -0.76 . . . . 1.25 108.947 173.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.69 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.2 OUTLIER -79.05 -37.01 40.07 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.006 -0.997 . . . . 1.24 110.391 175.535 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.537 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.5 -27.34 67.7 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.307 -0.998 . . . . 0.1 108.307 175.312 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.3 -31.84 55.0 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 114.532 -1.213 . . . . 0.82 108.49 173.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.69 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -69.03 -40.67 78.46 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.386 -1.279 . . . . 0.14 110.094 177.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -72.46 -40.31 67.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-N 115.57 -0.741 . . . . 0.16 110.59 178.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.639 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.78 -37.51 84.61 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.692 -0.855 . . . . 0.11 108.692 169.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.714 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.78 -19.38 65.79 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.485 0.66 . . . . 0.66 110.426 172.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 57' ' ' THR . 78.8 mttt -82.01 -21.46 37.01 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.395 -0.82 . . . . 1.92 109.646 173.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -85.34 -24.82 27.46 Favored 'General case' 0 CA--C 1.493 -1.226 0 CA-C-N 114.292 -1.322 . . . . 0.14 107.686 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.714 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.1 mm-40 -42.83 129.38 4.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.06 -1.882 . . . . 1.75 113.095 177.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.69 -17.89 56.67 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-N 115.052 -0.976 . . . . 0.26 111.536 -178.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.443 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.1 m -109.75 162.78 14.12 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.863 -0.421 . . . . 0.27 109.863 -177.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' A' ' 67' ' ' GLU . 14.1 ptm180 -66.42 -29.4 69.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.021 0.378 . . . . 3.05 112.021 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.741 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.1 tm-20 -58.54 -37.88 76.61 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-O 121.635 0.731 . . . . 2.51 109.421 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.681 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 35.7 t-80 -42.17 -45.44 4.06 Favored 'General case' 0 C--O 1.196 -1.754 0 CA-C-N 113.383 -1.735 . . . . 0.17 112.764 177.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.5 m -56.82 -54.12 50.06 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-O 123.027 1.394 . . . . 0.22 110.958 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.794 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.42 -44.17 92.08 Favored 'General case' 0 CA--C 1.475 -1.942 0 CA-C-N 111.619 -2.537 . . . . 0.21 107.346 -174.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.464 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.01 -20.89 40.78 Favored 'General case' 0 C--N 1.269 -2.914 0 CA-C-N 112.064 -2.334 . . . . 0.11 110.99 -173.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.662 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.5 tttp -76.6 -36.33 57.58 Favored 'General case' 0 N--CA 1.42 -1.94 0 N-CA-C 106.463 -1.68 . . . . 1.35 106.463 172.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 77' ' ' SER . 95.8 p -77.54 -12.1 59.93 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.184 -1.371 . . . . 1.18 109.61 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 14.1 mtpp -86.75 -56.48 3.39 Favored 'General case' 0 CA--C 1.489 -1.396 0 CA-C-O 121.973 0.892 . . . . 1.02 110.055 167.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 15.6 t80 -50.37 -57.36 8.12 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 113.328 -1.76 . . . . 0.25 111.124 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.662 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -67.29 -27.99 67.64 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 122.6 1.19 . . . . 0.65 108.402 -169.315 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.4 t -67.63 -56.66 8.52 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 112.548 -2.114 . . . . 0.1 108.202 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.748 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -64.65 -37.36 87.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.064 -1.88 . . . . 0.04 109.218 -175.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.76 -34.55 78.07 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-N 113.367 -1.742 . . . . 0.07 110.399 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.468 HG22 HG22 ' A' ' 119' ' ' THR . 35.7 m -75.0 -38.62 61.57 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.721 -0.672 . . . . 0.07 110.523 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' A' ' 119' ' ' THR . 38.5 mt-30 -67.02 -39.84 87.13 Favored 'General case' 0 N--CA 1.41 -2.448 0 CA-C-N 115.898 -0.592 . . . . 0.09 109.5 -177.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.734 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.34 -46.94 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.357 0 C-N-CA 117.951 -1.499 . . . . 0.06 109.332 174.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.1 OUTLIER -54.18 -32.72 56.29 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.283 0.563 . . . . 0.95 112.131 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.621 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.34 -49.16 70.46 Favored 'General case' 0 CA--C 1.479 -1.787 0 CA-C-N 114.651 -1.159 . . . . 0.05 110.209 173.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.742 HG23 ' HB ' ' A' ' 97' ' ' ILE . 72.3 mt -59.06 -44.57 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.61 0 CA-C-N 113.654 -1.612 . . . . 0.05 108.001 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.634 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.59 -52.37 65.94 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.075 -1.421 . . . . 0.09 108.225 178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -47.29 -57.42 5.24 Favored 'General case' 0 CA--C 1.49 -1.335 0 O-C-N 124.717 1.26 . . . . 0.4 110.024 -177.465 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.2 m -76.82 -40.4 31.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 CA-C-N 114.807 -1.088 . . . . 0.05 110.571 -172.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.9 m-20 -58.21 -30.14 66.24 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.858 0.837 . . . . 0.09 109.983 172.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 86' ' ' GLN . . . -74.41 -11.56 60.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.597 -1.638 . . . . 0.12 109.515 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.712 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.1 mm-40 -90.84 -18.21 25.22 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.183 -1.372 . . . . 0.25 109.446 179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.705 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.7 m-85 -99.24 156.43 16.98 Favored 'General case' 0 CA--C 1.495 -1.155 0 CA-C-O 122.037 0.922 . . . . 0.12 111.165 174.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.71 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.0 mt-10 -60.0 -27.35 66.8 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 113.406 -1.724 . . . . 0.45 109.247 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 8.0 mttm -145.27 144.15 22.46 Favored Pre-proline 0 CA--C 1.515 -0.383 0 N-CA-C 107.851 -1.166 . . . . 2.94 107.851 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 83.8 Cg_exo -47.1 136.41 18.15 Favored 'Trans proline' 0 CA--C 1.488 -1.778 0 C-N-CA 124.401 3.401 . . . . 0.14 113.092 -173.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.867 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.62 53.51 1.95 Allowed 'General case' 0 N--CA 1.411 -2.385 0 C-N-CA 116.948 -1.901 . . . . 0.06 111.357 173.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.742 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.24 99.07 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.468 -2.193 0 N-CA-C 103.986 -2.598 . . . . 0.1 103.986 149.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.885 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.1 m -132.16 117.18 31.82 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.615 0 C-N-CA 119.554 -0.858 . . . . 0.14 109.949 -176.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.708 ' C ' HG21 ' A' ' 37' ' ' THR . 11.1 t70 70.96 40.03 0.95 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.055 -1.429 . . . . 0.53 109.018 -170.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.033 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 68.98 3.26 35.22 Favored Glycine 0 CA--C 1.502 -0.73 0 CA-C-N 115.392 -0.822 . . . . 0.1 113.58 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.84 136.51 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.568 0 CA-C-O 122.568 1.175 . . . . 0.15 109.808 178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.867 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.21 151.81 46.87 Favored 'General case' 0 C--N 1.286 -2.187 0 CA-C-N 113.046 -1.888 . . . . 0.11 111.747 -175.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.52 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.9 t70 -102.22 93.6 5.29 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 113.861 -1.518 . . . . 0.48 107.172 174.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.765 ' HA ' HD21 ' A' ' 134' ' ' LEU . 3.0 p -67.51 -13.86 62.42 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-O 122.537 1.16 . . . . 0.2 110.056 -176.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.41 -4.31 59.12 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 112.902 -1.954 . . . . 0.9 109.65 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.662 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -68.39 174.24 4.23 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.937 -1.483 . . . . 0.2 111.315 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.71 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.5 mmmt -131.43 94.85 3.63 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 113.932 -1.486 . . . . 1.99 111.298 -168.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.53 99.31 0.3 Allowed 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.44 -0.578 . . . . 0.13 109.44 -178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.629 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.9 mtmt -44.64 162.09 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 114.478 -1.237 . . . . 0.26 113.238 -177.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.6 m -70.85 0.61 6.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.553 -0.749 . . . . 0.29 110.649 175.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -115.6 -14.48 11.48 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 114.903 -1.044 . . . . 1.51 109.113 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.712 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.24 114.6 0.7 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.609 1.195 . . . . 0.15 112.054 173.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -134.22 101.89 5.18 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 112.626 -2.079 . . . . 2.22 108.205 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.686 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.7 m-85 -89.26 158.86 17.69 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 113.626 0.972 . . . . 0.15 113.626 -168.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.13 138.38 46.63 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.621 -1.627 . . . . 0.2 108.892 175.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.12 72.77 0.19 Allowed 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.88 0.848 . . . . 1.36 109.097 174.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.496 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -76.56 121.14 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.728 0 CA-C-N 114.107 -1.406 . . . . 0.18 111.787 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -110.03 106.02 15.37 Favored 'General case' 0 CA--C 1.489 -1.386 0 CA-C-N 114.298 -1.319 . . . . 1.87 109.456 171.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.704 HG21 ' HA ' ' A' ' 81' ' ' GLN . 65.8 p -79.22 -13.44 59.69 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 112.858 -1.974 . . . . 0.16 108.524 175.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.27 -25.09 19.19 Favored Glycine 0 N--CA 1.423 -2.171 0 CA-C-N 114.031 -1.441 . . . . 0.18 110.985 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.535 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 53.4 t30 -82.58 88.63 6.66 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 107.588 -1.264 . . . . 0.45 107.588 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.832 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 41.8 m -49.96 -54.22 21.32 Favored 'General case' 0 C--O 1.202 -1.395 0 N-CA-C 113.736 1.013 . . . . 0.26 113.736 -172.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.804 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.0 OUTLIER -54.51 -36.99 64.8 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.928 0.394 . . . . 1.66 110.152 179.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.794 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.3 tp -71.53 -44.93 63.71 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.684 -0.858 . . . . 0.09 108.684 175.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 6.6 m-20 -55.55 -29.91 59.82 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.014 -1.448 . . . . 1.49 109.462 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.832 ' HG3' ' O ' ' A' ' 122' ' ' THR . 53.2 mttt -81.91 -25.55 34.87 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.354 -1.293 . . . . 1.29 112.714 174.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.804 HG23 ' O ' ' A' ' 123' ' ' GLU . 40.9 t -89.63 -29.45 5.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 108.706 -0.85 . . . . 0.09 108.706 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.794 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 61.2 mt -54.99 -48.43 73.31 Favored 'General case' 0 CA--C 1.501 -0.942 0 N-CA-C 106.508 -1.664 . . . . 0.07 106.508 171.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.49 -46.19 91.03 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-N 110.634 -2.985 . . . . 0.37 111.472 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.686 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.6 -43.53 12.26 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.572 -2.104 . . . . 1.66 109.885 177.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -70.45 -51.56 28.38 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 113.792 -1.549 . . . . 0.06 109.983 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 114' ' ' PHE . 2.0 mt -52.89 -22.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 115.448 -0.797 . . . . 0.09 111.294 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.18 -17.4 52.49 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 115.15 -0.932 . . . . 1.33 109.768 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.765 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.3 mp -78.69 -30.44 46.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.796 -1.093 . . . . 0.1 108.671 170.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.861 0 CA-C-O 118.651 -1.083 . . . . 1.19 112.704 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 111.939 -0.464 . . . . 22.48 111.939 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -134.75 84.66 2.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.967 -0.383 . . . . 23.33 109.967 -179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtt -127.83 -69.05 0.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 22.11 110.932 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -133.61 63.61 1.63 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.177 -0.465 . . . . 20.59 110.15 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.48 -25.75 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.953 0.406 . . . . 18.37 110.908 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.52 38.71 22.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.442 -0.799 . . . . 16.65 110.843 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 -61.51 -29.21 69.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.594 -0.73 . . . . 17.53 111.556 -174.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -64.48 -26.62 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.386 -0.37 . . . . 15.09 111.115 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.8 m -104.99 -63.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.092 0.473 . . . . 13.75 110.463 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtpt -78.95 81.93 5.18 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.678 -0.692 . . . . 14.58 109.525 -177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -72.19 69.34 0.77 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.763 -1.108 . . . . 13.16 111.118 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.04 100.28 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.199 -0.91 . . . . 10.1 109.663 175.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -125.53 -62.4 1.2 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.234 -0.439 . . . . 10.66 110.494 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.1 t -165.66 -51.82 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.217 -0.447 . . . . 7.42 111.129 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.4 p -172.35 79.58 0.05 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.019 0.438 . . . . 6.06 110.36 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -94.08 -64.86 1.03 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.064 -0.516 . . . . 6.06 110.088 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 p -162.41 -90.66 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 2.91 110.315 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.523 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 5.9 p -157.13 -81.78 0.06 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.823 0.82 . . . . 1.44 109.67 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.613 ' C ' ' HB3' ' A' ' 65' ' ' SER . 12.5 m 63.25 152.34 0.04 OUTLIER 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 113.307 -1.77 . . . . 1.25 112.353 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.856 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -92.39 -167.0 1.66 Allowed 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 114.649 -1.16 . . . . 0.39 111.743 -173.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.516 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 3.5 m-80 -114.03 141.12 47.83 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 106.048 -1.834 . . . . 0.43 106.048 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.709 HE21 ' HB ' ' A' ' 25' ' ' VAL . 0.5 OUTLIER -75.34 -11.34 60.03 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 119.421 -0.912 . . . . 1.0 110.348 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 p -82.6 -8.56 59.6 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 108.445 -0.946 . . . . 1.36 108.445 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.601 ' OD1' ' HB3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -94.68 -54.35 3.53 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 123.03 1.395 . . . . 1.27 108.72 173.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.709 ' HB ' HE21 ' A' ' 22' ' ' GLN . 55.5 t -72.17 -44.66 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.827 0 CA-C-N 111.956 -2.384 . . . . 1.01 110.86 -163.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.15 -55.18 30.21 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.62 -1.173 . . . . 0.51 111.438 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -65.34 -38.65 90.75 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 110.26 -0.274 . . . . 0.45 110.26 -177.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.575 ' CE1' HD13 ' A' ' 55' ' ' LEU . 65.8 t80 -54.21 -62.83 1.4 Allowed 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 107.822 -1.177 . . . . 0.13 107.822 174.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.677 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.0 m-80 -61.24 -28.79 69.42 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 113.547 -1.66 . . . . 0.3 111.529 -175.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.4 m -77.01 -47.24 21.22 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 115.585 -0.734 . . . . 0.2 110.911 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.687 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.2 tp -67.73 -34.46 76.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 106.961 -1.496 . . . . 0.53 106.961 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.693 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 39.6 t80 -62.58 -49.14 76.43 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 112.879 -1.964 . . . . 0.15 110.988 176.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.6 -25.29 67.33 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-O 122.485 1.136 . . . . 0.52 108.773 178.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.99 -33.64 63.9 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 112.727 -2.033 . . . . 0.1 111.11 -176.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.733 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.4 m-85 -61.52 -21.39 64.2 Favored 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 109.189 -0.671 . . . . 0.08 109.189 176.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.659 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.8 m-85 -95.51 125.49 40.15 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 114.948 -1.024 . . . . 0.11 109.505 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.67 HG21 ' C ' ' A' ' 99' ' ' ASP . 6.5 p -61.0 -23.72 65.6 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 113.601 -1.636 . . . . 0.17 110.874 -178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.3 p30 -148.59 154.75 40.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.205 -1.035 . . . . 1.52 108.205 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 p -76.56 4.48 9.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.784 0.661 . . . . 0.36 112.784 -169.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 48.4 m-80 -79.06 -13.49 59.73 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.464 -0.939 . . . . 1.15 108.464 168.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.46 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 54.26 41.52 31.95 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-N 114.095 -1.412 . . . . 0.66 110.573 174.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 123' ' ' GLU . 39.2 p -104.99 -1.6 25.56 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 112.329 -2.214 . . . . 0.21 109.651 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.046 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -154.64 147.54 24.51 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.387 -1.278 . . . . 0.1 109.279 -172.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.88 139.64 53.3 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.715 1.376 . . . . 0.09 114.715 -171.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HG2' HG22 ' A' ' 37' ' ' THR . 14.1 mmtm -87.88 135.37 33.43 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 113.643 -1.617 . . . . 1.95 108.999 176.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.909 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.8 m120 -86.58 -27.38 23.94 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-N 114.457 -1.247 . . . . 1.78 111.967 -168.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.6 m -62.8 -27.55 69.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.287 0.565 . . . . 1.32 110.18 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.523 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 14.6 mm100 -72.08 -24.42 61.5 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.753 -0.658 . . . . 0.82 111.494 -178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.457 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.6 m-30 -56.68 -23.08 39.39 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.755 0.312 . . . . 0.13 111.54 -176.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -73.56 -23.89 60.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.179 0.99 . . . . 0.41 109.325 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.642 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.2 mttt -96.92 10.2 39.78 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.993 -1.458 . . . . 1.47 109.834 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.28 -39.97 81.99 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.462 -0.495 . . . . 0.09 110.408 177.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.4 m -68.57 -20.19 64.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.539 0.685 . . . . 1.25 109.228 172.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.11 -37.21 34.1 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.108 -0.951 . . . . 1.24 110.023 174.058 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 28' ' ' PHE . 0.2 OUTLIER -67.49 -27.45 67.02 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.515 -0.92 . . . . 0.1 108.515 175.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 0.3 OUTLIER -79.55 -24.31 42.24 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.638 -1.165 . . . . 0.82 108.569 173.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -77.28 -42.58 36.47 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 114.085 -1.416 . . . . 0.14 109.53 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.721 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.1 mt -69.52 -41.75 75.6 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.68 -0.691 . . . . 0.16 109.634 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.625 HD13 ' NE2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.22 -39.03 85.19 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.018 -0.734 . . . . 0.11 109.018 170.14 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.704 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.75 -17.11 63.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.529 0.681 . . . . 0.66 110.834 174.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.692 ' HG3' ' O ' ' A' ' 57' ' ' THR . 4.2 mtpm? -86.51 -24.54 25.51 Favored 'General case' 0 N--CA 1.425 -1.69 0 CA-C-N 115.25 -0.886 . . . . 1.92 109.48 174.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.721 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -81.46 -22.35 38.15 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 106.931 -1.507 . . . . 0.14 106.931 178.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 1.3 mm-40 -44.1 126.35 4.93 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 112.459 -2.155 . . . . 1.75 113.048 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.42 -11.97 70.62 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.265 -0.88 . . . . 0.26 111.29 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.613 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.3 m -108.24 168.14 9.51 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.432 -0.581 . . . . 0.27 109.432 178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.533 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 25.0 ptt180 -73.38 -30.65 63.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.229 0.538 . . . . 3.05 110.636 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.856 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.5 mm-40 -58.47 -36.5 73.81 Favored 'General case' 0 CA--C 1.483 -1.613 0 CA-C-N 114.909 -1.042 . . . . 2.51 109.623 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.669 ' NE2' ' HG2' ' A' ' 63' ' ' GLU . 38.7 t-80 -41.56 -45.73 3.38 Favored 'General case' 0 C--O 1.191 -1.976 0 CA-C-N 114.204 -1.362 . . . . 0.17 112.381 177.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.6 m -58.43 -53.94 52.62 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.786 1.279 . . . . 0.22 111.222 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.776 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.72 -43.73 92.48 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 112.075 -2.329 . . . . 0.21 107.36 -175.342 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.438 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.59 -20.77 39.15 Favored 'General case' 0 N--CA 1.404 -2.726 0 CA-C-N 111.683 -2.508 . . . . 0.11 110.791 -172.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 9.2 tttm -76.85 -34.82 57.82 Favored 'General case' 0 CA--C 1.477 -1.842 0 N-CA-C 106.382 -1.71 . . . . 1.35 106.382 171.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.1 t -75.54 -17.78 59.98 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 113.505 -1.68 . . . . 1.18 109.684 177.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 12.7 mtpp -85.01 -54.47 4.62 Favored 'General case' 0 CA--C 1.488 -1.438 0 CA-C-O 122.085 0.945 . . . . 1.02 109.7 170.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 12.8 t80 -51.59 -56.3 14.34 Favored 'General case' 0 N--CA 1.424 -1.769 0 CA-C-N 113.104 -1.862 . . . . 0.25 110.803 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -65.63 -32.31 73.82 Favored 'General case' 0 CA--C 1.499 -1.01 0 CA-C-O 122.532 1.158 . . . . 0.65 108.024 -169.807 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.582 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 29.9 t -64.46 -55.84 18.14 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.448 -2.16 . . . . 0.1 108.46 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.733 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.46 -37.61 87.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 113.072 -1.877 . . . . 0.04 109.281 -175.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.724 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.67 -31.13 71.6 Favored 'General case' 0 CA--C 1.49 -1.36 0 CA-C-N 113.327 -1.76 . . . . 0.07 110.381 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.0 m -79.59 -37.14 36.97 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 115.505 -0.77 . . . . 0.07 110.501 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.745 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.6 mt-30 -66.77 -39.77 87.97 Favored 'General case' 0 N--CA 1.409 -2.504 0 N-CA-C 109.167 -0.679 . . . . 0.09 109.167 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.742 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -74.95 -49.38 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.342 0 C-N-CA 117.965 -1.494 . . . . 0.06 109.414 174.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.724 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.4 mptt -51.23 -33.43 27.92 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 112.776 0.658 . . . . 0.95 112.776 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.605 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.67 -49.28 71.58 Favored 'General case' 0 CA--C 1.478 -1.8 0 CA-C-O 121.921 0.867 . . . . 0.05 110.294 173.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.793 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.1 mt -59.07 -44.74 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.594 0 CA-C-N 113.468 -1.696 . . . . 0.05 108.114 178.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.06 -50.58 73.52 Favored 'General case' 0 N--CA 1.407 -2.618 0 CA-C-N 114.002 -1.454 . . . . 0.09 108.241 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.561 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -48.5 -57.57 5.94 Favored 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 125.092 1.495 . . . . 0.4 110.179 -178.216 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.605 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.7 -38.89 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 115.089 -0.96 . . . . 0.05 110.296 -172.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.693 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.3 m-20 -58.96 -29.19 66.98 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 122.032 0.92 . . . . 0.09 109.857 172.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.07 -11.19 60.25 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.477 -1.692 . . . . 0.12 109.709 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.696 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 19.2 mm-40 -90.82 -20.31 22.47 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.034 -1.439 . . . . 0.25 109.33 179.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.1 m-85 -97.63 157.7 15.89 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 122.001 0.905 . . . . 0.12 111.393 176.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.705 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 17.0 mt-10 -62.72 -26.21 68.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.527 -1.669 . . . . 0.45 109.14 177.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.3 mtpt -145.76 144.27 21.89 Favored Pre-proline 0 CA--C 1.515 -0.395 0 CA-C-N 114.394 -1.275 . . . . 2.94 107.56 173.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.693 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 97.5 Cg_exo -46.95 138.06 16.0 Favored 'Trans proline' 0 CA--C 1.487 -1.827 0 C-N-CA 124.539 3.493 . . . . 0.14 113.301 -174.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.881 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.5 54.11 1.94 Allowed 'General case' 0 N--CA 1.408 -2.531 0 C-N-CA 116.909 -1.916 . . . . 0.06 111.59 172.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.793 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.77 98.66 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.474 -1.963 0 N-CA-C 104.794 -2.299 . . . . 0.1 104.794 149.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.909 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 17.8 m -131.91 112.94 21.16 Favored 'Isoleucine or valine' 0 C--N 1.268 -2.961 0 C-N-CA 119.248 -0.981 . . . . 0.14 109.678 -175.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.67 ' C ' HG21 ' A' ' 37' ' ' THR . 32.5 t70 77.33 39.29 0.2 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.135 -1.393 . . . . 0.53 109.609 -171.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.046 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.61 4.41 25.23 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.643 -0.708 . . . . 0.1 112.77 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.8 p -129.35 137.17 57.67 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-O 122.472 1.13 . . . . 0.15 109.79 177.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.881 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.5 152.57 45.43 Favored 'General case' 0 C--N 1.284 -2.265 0 CA-C-N 113.246 -1.797 . . . . 0.11 111.845 -175.571 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.489 ' O ' HD21 ' A' ' 134' ' ' LEU . 1.1 t70 -102.8 93.76 5.24 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 106.762 -1.57 . . . . 0.48 106.762 175.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.809 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.8 p -68.2 -12.97 61.87 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 122.389 1.09 . . . . 0.2 110.218 -176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.3 -4.75 59.26 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 113.16 -1.837 . . . . 0.9 109.567 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.673 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -69.06 172.1 7.24 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.658 -1.61 . . . . 0.2 111.301 -178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.705 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.4 mmmt -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 113.923 -1.49 . . . . 1.99 111.293 -168.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -63.05 100.75 0.23 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.904 -0.776 . . . . 0.13 108.904 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.653 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 48.8 mtmt -47.11 165.36 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.431 -1.258 . . . . 0.26 113.296 -177.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 49.4 m -73.19 1.51 9.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.303 -0.862 . . . . 0.29 109.68 171.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.427 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.2 t70 -111.32 -15.43 13.6 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.223 -1.353 . . . . 1.51 108.603 -178.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.696 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -52.47 115.92 2.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.583 1.183 . . . . 0.15 111.885 175.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 5.0 ttpp -136.99 101.3 4.53 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 112.634 -2.075 . . . . 2.22 108.056 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.5 m-85 -88.94 158.56 18.01 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-O 122.173 0.987 . . . . 0.15 113.459 -166.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.16 137.38 50.08 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 113.406 -1.724 . . . . 0.2 108.033 174.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.79 68.36 0.63 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 122.001 0.905 . . . . 1.36 109.251 177.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.9 mt -68.77 121.75 18.72 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 CA-C-N 113.574 -1.648 . . . . 0.18 112.128 -171.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -111.03 106.06 15.02 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.229 -1.351 . . . . 1.87 110.709 167.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.745 HG21 ' HA ' ' A' ' 81' ' ' GLN . 61.8 p -75.22 -19.22 59.89 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 112.688 -2.051 . . . . 0.16 108.982 175.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 99.57 -17.69 57.26 Favored Glycine 0 N--CA 1.427 -1.924 0 CA-C-N 114.15 -1.386 . . . . 0.18 110.655 -169.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 55.8 t30 -92.33 90.47 7.26 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 107.94 -1.133 . . . . 0.45 107.94 174.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.843 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 53.7 m -51.76 -56.19 15.3 Favored 'General case' 0 C--O 1.204 -1.302 0 N-CA-C 113.357 0.873 . . . . 0.26 113.357 -173.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.792 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -52.52 -34.73 51.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 120.791 0.329 . . . . 1.66 110.592 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.741 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 13.7 tp -72.77 -45.72 57.13 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.467 -0.788 . . . . 0.09 108.888 176.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 91.1 m-20 -56.91 -31.98 65.46 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 115.244 -0.889 . . . . 1.49 109.157 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.843 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.2 mtpt -80.47 -15.06 57.66 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.509 -1.223 . . . . 1.29 112.518 176.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.5 t -96.82 -29.97 3.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.01 -0.737 . . . . 0.09 109.01 174.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.1 mt -55.34 -48.07 74.74 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.359 -1.719 . . . . 0.07 106.359 172.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.8 OUTLIER -55.49 -49.68 71.9 Favored 'General case' 0 CA--C 1.493 -1.236 0 CA-C-N 110.385 -3.098 . . . . 0.37 111.744 178.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.588 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.36 -44.63 8.38 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 112.09 -2.323 . . . . 1.66 110.206 178.787 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.22 -51.99 32.31 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 113.997 -1.456 . . . . 0.06 109.776 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.5 mt -52.97 -21.29 3.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.377 -0.829 . . . . 0.09 111.422 175.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 2.0 t -81.16 -18.88 44.78 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.32 -0.855 . . . . 1.33 109.77 -178.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.809 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.8 mp -79.21 -30.64 43.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.803 -1.09 . . . . 0.1 108.414 169.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.642 -1.088 . . . . 1.19 112.452 178.33 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.106 -0.398 . . . . 22.48 112.106 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -98.87 29.76 3.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 23.33 111.116 -177.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ptm -133.67 32.74 3.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.056 0.455 . . . . 22.11 110.665 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -76.18 142.62 41.48 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.757 -0.46 . . . . 20.59 109.757 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.4 m -79.23 112.91 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.625 0.726 . . . . 18.37 111.057 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.509 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -84.67 60.67 6.26 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.551 -0.75 . . . . 16.65 110.403 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -66.19 -19.18 65.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.465 -0.789 . . . . 17.53 112.209 -173.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.5 m -122.9 25.1 8.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.056 0.455 . . . . 15.09 110.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.509 ' HB ' ' HB1' ' A' ' 6' ' ' ALA . 4.0 m -115.39 168.35 10.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.713 -0.477 . . . . 13.75 109.713 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' H ' HG22 ' A' ' 9' ' ' THR . 22.6 tptm 71.37 28.62 2.91 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 121.844 0.831 . . . . 14.58 110.188 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -127.7 109.89 12.11 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.599 -0.728 . . . . 13.16 110.152 177.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.7 mt -77.75 90.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.567 0.698 . . . . 10.1 110.1 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.41 ' O ' ' HB ' ' A' ' 14' ' ' THR . 45.0 mt-10 -125.25 -163.92 1.24 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.548 -0.751 . . . . 10.66 110.518 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 13' ' ' GLU . 44.0 m 76.89 -51.93 0.57 Allowed 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.983 0.802 . . . . 7.42 111.941 173.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.7 m -77.54 39.92 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.151 0.501 . . . . 6.06 111.179 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -133.9 1.52 3.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.402 0.62 . . . . 6.06 109.71 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 19' ' ' THR . 22.0 t -170.82 -168.6 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.227 -0.897 . . . . 2.91 108.965 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.639 ' O ' ' HA ' ' A' ' 65' ' ' SER . 7.0 t -87.2 22.69 2.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.37 1.081 . . . . 1.44 109.589 176.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.537 ' HA ' ' CG ' ' A' ' 66' ' ' ARG . 16.9 m -37.79 143.2 0.12 Allowed 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 112.528 -2.123 . . . . 1.25 114.009 -177.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.701 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -71.54 177.85 3.82 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.295 -1.775 . . . . 0.39 111.758 -178.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 6.8 m-80 -112.15 156.5 22.17 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 113.472 -1.694 . . . . 0.43 107.674 -176.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.64 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -77.31 -12.42 59.95 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 119.788 -0.765 . . . . 1.0 110.376 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.0 m -79.59 -12.41 59.84 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 108.213 -1.032 . . . . 1.36 108.213 171.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.692 ' HB3' HD13 ' A' ' 62' ' ' LEU . 51.6 m-20 -97.18 -47.67 5.66 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 114.341 -1.299 . . . . 1.27 108.948 175.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.64 ' HB ' HE21 ' A' ' 22' ' ' GLN . 53.7 t -85.51 -53.15 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 113.267 -1.788 . . . . 1.01 113.251 -164.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -54.2 -52.61 60.71 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.147 -0.478 . . . . 0.51 111.172 -175.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.74 -36.07 79.9 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 110.101 -0.333 . . . . 0.45 110.101 -179.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.543 ' CE1' HD13 ' A' ' 55' ' ' LEU . 74.5 t80 -54.91 -64.07 0.95 Allowed 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 107.947 -1.131 . . . . 0.13 107.947 174.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.592 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.1 m-80 -60.9 -26.67 67.6 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.271 -1.786 . . . . 0.3 111.448 -174.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.21 -46.31 15.03 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.541 -0.754 . . . . 0.2 110.891 -175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 20.5 tp -69.95 -32.53 70.83 Favored 'General case' 0 N--CA 1.433 -1.289 0 N-CA-C 107.084 -1.45 . . . . 0.53 107.084 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 40.2 t80 -63.5 -46.82 84.36 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.147 -1.842 . . . . 0.15 110.489 175.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -24.27 67.54 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.872 -1.058 . . . . 0.52 109.108 177.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -78.28 -32.99 49.78 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 113.074 -1.876 . . . . 0.1 111.319 -174.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.721 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.7 m-85 -60.58 -23.82 64.97 Favored 'General case' 0 CA--C 1.493 -1.229 0 N-CA-C 108.65 -0.87 . . . . 0.08 108.65 176.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 80.5 m-85 -94.92 120.0 34.41 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 114.643 -1.162 . . . . 0.11 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 2.4 p -62.39 -28.23 69.64 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 113.367 -1.742 . . . . 0.17 111.92 -176.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.54 ' C ' ' H ' ' A' ' 40' ' ' ASN . 62.8 t30 -119.52 -1.69 10.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.117 -0.492 . . . . 1.52 111.996 -164.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.481 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 77.8 p 55.23 -10.76 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.204 1.001 . . . . 0.36 113.627 -173.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.54 ' H ' ' C ' ' A' ' 38' ' ' ASN . 16.0 m120 -70.99 -12.51 61.57 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.136 -1.061 . . . . 1.15 108.136 163.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.64 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 7.7 mtpt 57.13 41.41 27.27 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-N 113.19 -1.823 . . . . 0.66 110.231 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.592 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 64.6 p -113.09 3.66 16.23 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 112.275 -2.239 . . . . 0.21 109.101 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.035 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -157.73 144.23 17.78 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.073 -1.421 . . . . 0.1 109.296 -172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.726 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -127.87 141.98 51.4 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 114.629 1.344 . . . . 0.09 114.629 -172.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.3 mmmm -90.7 129.92 36.75 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 113.651 -1.613 . . . . 1.95 110.023 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.879 ' ND2' ' HA ' ' A' ' 98' ' ' VAL . 11.7 m-80 -77.65 -23.97 49.56 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.599 -1.182 . . . . 1.78 111.446 -172.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 m -66.74 -30.58 70.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.888 -0.596 . . . . 1.32 110.44 177.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 66.0 mm-40 -68.58 -24.7 64.63 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.665 -0.698 . . . . 0.82 111.819 178.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.568 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.5 m-30 -58.66 -18.8 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.839 0.311 . . . . 0.13 111.839 -175.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -78.85 -20.85 48.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 122.072 0.939 . . . . 0.41 109.029 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HD2' HD11 ' A' ' 31' ' ' LEU . 0.1 OUTLIER -99.53 10.03 42.12 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 114.212 -1.358 . . . . 1.47 110.438 177.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.672 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.52 -39.62 88.72 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.348 -0.541 . . . . 0.09 110.452 178.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.3 p -67.29 -21.8 65.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.473 0.654 . . . . 1.25 109.263 172.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.693 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.8 OUTLIER -79.15 -38.01 37.08 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.129 -0.941 . . . . 1.24 110.313 175.228 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.574 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.41 -28.23 68.46 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 108.276 -1.009 . . . . 0.1 108.276 174.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.2 tptp -77.59 -29.04 51.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.453 -1.248 . . . . 0.82 108.638 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.697 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.18 -38.95 72.11 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.7 -1.136 . . . . 0.14 109.711 178.023 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.76 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.9 mt -72.7 -41.07 65.67 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 115.032 -0.986 . . . . 0.16 110.539 177.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.88 -35.3 79.56 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.161 -0.681 . . . . 0.11 109.161 169.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.98 -22.55 66.97 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.546 -0.752 . . . . 0.66 109.99 172.116 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG3' ' O ' ' A' ' 57' ' ' THR . 53.0 mttm -81.26 -21.17 39.62 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.009 -0.996 . . . . 1.92 109.55 174.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.76 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.37 -22.07 25.28 Favored 'General case' 0 CA--C 1.49 -1.333 0 CA-C-N 114.337 -1.301 . . . . 0.14 107.797 178.367 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.681 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.7 mt-10 -46.67 128.32 10.43 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 113.629 -1.623 . . . . 1.75 112.07 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.69 -8.4 79.41 Favored Glycine 0 N--CA 1.435 -1.369 0 CA-C-N 115.27 -0.877 . . . . 0.26 111.601 -178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' THR . 1.3 m -108.19 169.39 8.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.056 -0.72 . . . . 0.27 109.056 178.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.601 ' HG3' ' OE2' ' A' ' 67' ' ' GLU . 2.4 ptm180 -76.72 -29.28 56.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.453 0.644 . . . . 3.05 110.753 178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.701 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.7 mp0 -58.64 -35.84 73.16 Favored 'General case' 0 CA--C 1.485 -1.557 0 CA-C-N 115.102 -0.954 . . . . 2.51 110.491 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.678 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 27.6 t-80 -41.76 -45.17 3.47 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 113.345 -1.752 . . . . 0.17 112.57 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -56.53 -53.8 53.27 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 122.946 1.355 . . . . 0.22 111.012 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.793 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.41 -44.17 88.26 Favored 'General case' 0 CA--C 1.474 -1.969 0 CA-C-N 111.573 -2.558 . . . . 0.21 107.49 -174.333 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.465 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.95 -22.11 36.88 Favored 'General case' 0 C--N 1.277 -2.575 0 CA-C-N 111.846 -2.433 . . . . 0.11 111.039 -172.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 23.8 tttp -75.05 -35.49 61.89 Favored 'General case' 0 CA--C 1.476 -1.878 0 N-CA-C 106.245 -1.761 . . . . 1.35 106.245 170.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 27.8 t -74.88 -17.81 60.52 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.427 -1.715 . . . . 1.18 109.767 178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.793 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 15.5 mtpp -85.41 -54.63 4.46 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.048 0.928 . . . . 1.02 109.811 170.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.432 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 18.4 t80 -52.55 -56.62 13.97 Favored 'General case' 0 N--CA 1.425 -1.682 0 CA-C-N 113.347 -1.752 . . . . 0.25 110.891 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.729 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -66.89 -28.4 68.29 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 122.72 1.248 . . . . 0.65 108.29 -169.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 35.0 t -68.84 -55.76 10.13 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.447 -2.16 . . . . 0.1 108.5 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -64.97 -37.52 87.91 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 113.271 -1.786 . . . . 0.04 109.192 -175.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.55 -32.93 74.59 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 113.441 -1.709 . . . . 0.07 110.086 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 31.7 m -75.4 -39.1 59.45 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.542 -0.753 . . . . 0.07 110.544 177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.783 ' HA ' HG21 ' A' ' 119' ' ' THR . 39.0 mt-30 -66.47 -39.58 88.89 Favored 'General case' 0 N--CA 1.41 -2.431 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.726 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.24 -48.42 31.64 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.389 0 C-N-CA 118.191 -1.403 . . . . 0.06 109.37 174.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.698 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -52.68 -32.81 44.33 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.053 0.454 . . . . 0.95 112.181 179.252 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.615 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.74 -49.32 68.87 Favored 'General case' 0 CA--C 1.477 -1.846 0 CA-C-N 115.016 -0.993 . . . . 0.05 110.168 174.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.748 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.1 mt -58.99 -44.52 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.58 0 CA-C-N 113.5 -1.682 . . . . 0.05 107.871 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.602 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -58.8 -51.83 68.3 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 114.135 -1.393 . . . . 0.09 108.38 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.518 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -47.89 -56.84 6.63 Favored 'General case' 0 CA--C 1.491 -1.303 0 O-C-N 124.891 1.369 . . . . 0.4 110.087 -177.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.615 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.3 m -76.48 -40.65 34.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 114.871 -1.059 . . . . 0.05 110.42 -173.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.707 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.0 m-20 -58.7 -28.38 65.74 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 122.008 0.908 . . . . 0.09 110.076 173.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.02 -13.56 60.88 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 113.518 -1.674 . . . . 0.12 109.66 -177.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.713 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 18.3 mm-40 -90.31 -18.86 24.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.143 -1.39 . . . . 0.25 109.473 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.685 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 31.1 m-85 -98.99 156.85 16.71 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.858 0.837 . . . . 0.12 111.556 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.711 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 10.7 mt-10 -61.61 -25.31 67.27 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 113.574 -1.648 . . . . 0.45 109.364 176.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 20.7 pttm -146.7 145.01 21.49 Favored Pre-proline 0 CA--C 1.505 -0.752 0 CA-C-N 114.325 -1.307 . . . . 2.94 109.185 171.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.707 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -46.22 134.8 15.36 Favored 'Trans proline' 0 CA--C 1.488 -1.806 0 C-N-CA 124.34 3.36 . . . . 0.14 112.736 -174.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.842 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -129.37 52.9 1.93 Allowed 'General case' 0 N--CA 1.409 -2.492 0 C-N-CA 116.786 -1.966 . . . . 0.06 111.142 174.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.748 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.42 99.39 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 N-CA-C 104.082 -2.562 . . . . 0.1 104.082 149.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.879 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 16.5 m -132.94 115.96 25.33 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.57 0 C-N-CA 119.748 -0.781 . . . . 0.14 109.94 -176.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 15.6 t70 74.31 37.11 0.6 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.18 -1.373 . . . . 0.53 109.453 -172.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.035 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.22 1.88 51.66 Favored Glycine 0 CA--C 1.501 -0.803 0 CA-C-N 115.49 -0.777 . . . . 0.1 113.217 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.0 p -128.93 137.39 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.518 0 CA-C-O 122.457 1.122 . . . . 0.15 110.059 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.842 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -66.89 151.23 47.96 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.141 -1.845 . . . . 0.11 111.464 -175.703 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 106' ' ' ALA . 1.1 t70 -102.98 93.86 5.25 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.166 -1.379 . . . . 0.48 107.416 176.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.819 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.8 p -68.23 -11.54 59.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 122.451 1.12 . . . . 0.2 109.958 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -86.67 -2.41 58.49 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 113.097 -1.865 . . . . 0.9 109.384 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.636 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.32 175.86 6.51 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.699 -1.592 . . . . 0.2 111.533 -179.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.711 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.9 mmmt -136.0 95.92 3.31 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 113.866 -1.515 . . . . 1.99 111.261 -168.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.35 100.2 0.23 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.206 -0.664 . . . . 0.13 109.206 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.652 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 49.0 mtmt -46.57 167.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 114.385 -1.279 . . . . 0.26 113.961 -176.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.0 m -71.74 0.41 8.96 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.669 -1.151 . . . . 0.29 110.323 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 109' ' ' LYS . 24.0 t70 -116.4 -16.33 10.86 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.691 -1.141 . . . . 1.51 108.886 -176.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.713 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.06 115.93 1.23 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 122.61 1.195 . . . . 0.15 112.383 175.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.64 102.11 5.0 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 112.675 -2.057 . . . . 2.22 108.094 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.698 ' CG ' HG23 ' A' ' 132' ' ' ILE . 82.9 m-85 -88.97 154.31 20.32 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.51 1.148 . . . . 0.15 114.084 -168.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 p -126.99 133.84 50.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 112.757 -2.02 . . . . 0.2 107.962 175.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -72.06 68.79 0.71 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 122.192 0.996 . . . . 1.36 109.164 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.5 HG21 ' CB ' ' A' ' 84' ' ' ALA . 14.0 mt -71.8 120.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.609 -1.632 . . . . 0.18 112.598 -171.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -108.97 107.15 17.41 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 114.475 -1.239 . . . . 1.87 110.605 167.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 81' ' ' GLN . 58.1 p -76.28 -20.56 57.22 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 112.778 -2.01 . . . . 0.16 108.736 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 100.02 -16.25 58.51 Favored Glycine 0 N--CA 1.425 -2.045 0 CA-C-N 114.22 -1.354 . . . . 0.18 110.96 -170.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.592 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 44.5 t30 -90.54 87.2 6.65 Favored 'General case' 0 C--O 1.215 -0.717 0 N-CA-C 109.361 -0.607 . . . . 0.45 109.361 176.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 32.5 m -44.57 -59.63 2.37 Favored 'General case' 0 C--O 1.214 -0.803 0 N-CA-C 113.779 1.029 . . . . 0.26 113.779 -169.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.8 mt-10 -53.98 -36.74 63.23 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.154 0.284 . . . . 1.66 110.288 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.6 tp -69.48 -45.96 67.76 Favored 'General case' 0 C--O 1.208 -1.084 0 N-CA-C 108.945 -0.761 . . . . 0.09 108.945 176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.579 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.3 m-20 -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.004 -0.998 . . . . 1.49 109.118 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' THR . 4.5 mtpm? -78.91 -22.45 45.84 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.564 -1.198 . . . . 1.29 112.582 175.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.5 t -91.8 -29.39 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 N-CA-C 108.761 -0.829 . . . . 0.09 108.761 179.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.1 mt -55.03 -48.45 73.39 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 106.716 -1.587 . . . . 0.07 106.716 171.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.58 -45.58 93.44 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 110.597 -3.001 . . . . 0.37 111.458 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.636 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -45.73 -44.01 13.34 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 112.643 -2.071 . . . . 1.66 109.979 177.262 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.705 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.86 -51.52 32.63 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.941 -1.481 . . . . 0.06 109.765 -179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.21 -22.17 4.58 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.338 -0.846 . . . . 0.09 111.311 175.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -79.47 -18.22 52.53 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 115.331 -0.85 . . . . 1.33 109.753 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.819 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.1 mp -79.89 -27.46 40.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.669 -1.15 . . . . 0.1 109.112 170.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.748 -1.029 . . . . 1.19 112.658 178.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 112.25 -0.34 . . . . 22.48 112.25 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -60.32 -50.46 73.53 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.041 0.386 . . . . 23.33 112.041 -176.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.5 mmt -77.35 -50.81 11.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.85 -0.34 . . . . 22.11 110.503 -177.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -143.24 153.28 42.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.435 . . . . 20.59 110.17 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 ' OG ' ' A' ' 8' ' ' SER . 12.6 t -117.14 73.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.405 0.622 . . . . 18.37 109.698 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.29 -13.23 20.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.746 -0.661 . . . . 16.65 111.309 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.89 -4.57 44.48 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.794 0.294 . . . . 17.53 111.794 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.463 ' OG ' HG12 ' A' ' 5' ' ' VAL . 9.7 m -50.73 -53.48 31.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.198 0.444 . . . . 15.09 112.198 -176.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.6 m -104.56 21.37 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.341 0.591 . . . . 13.75 110.535 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -103.15 63.42 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.153 0.501 . . . . 14.58 109.956 177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -113.44 127.36 56.08 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.821 -0.627 . . . . 13.16 110.022 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.8 mt -65.62 112.78 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.125 -0.489 . . . . 10.1 109.842 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.53 -56.33 1.89 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.831 -0.622 . . . . 10.66 110.011 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 t -116.4 125.27 51.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.571 -0.741 . . . . 7.42 110.063 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' GLN . 13.6 m -119.56 127.23 52.8 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.722 -0.473 . . . . 6.06 109.722 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HB3' ' O ' ' A' ' 15' ' ' SER . 7.2 tt0 69.54 128.55 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.845 0.715 . . . . 6.06 110.903 -177.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.1 m -70.54 167.54 18.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.311 -0.404 . . . . 2.91 110.947 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.429 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 27.3 p -51.57 149.76 4.22 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.335 0.865 . . . . 1.44 113.335 -176.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.551 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 6.7 m -140.86 148.03 39.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.685 -0.688 . . . . 1.25 109.775 175.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -77.27 -176.22 4.03 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 122.312 1.053 . . . . 0.39 112.258 -174.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 7.5 m-80 -120.9 150.12 41.56 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 113.405 -1.725 . . . . 0.43 107.213 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.597 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -75.54 -11.95 60.13 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 120.412 -0.515 . . . . 1.0 111.27 -178.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -81.67 -12.93 58.47 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 108.412 -0.959 . . . . 1.36 108.412 170.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.592 ' HB3' HD13 ' A' ' 62' ' ' LEU . 93.1 m-20 -97.94 -43.1 7.23 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 114.119 -1.4 . . . . 1.27 109.456 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.608 HG22 HD11 ' A' ' 62' ' ' LEU . 70.3 t -88.46 -55.45 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.032 -1.44 . . . . 1.01 112.65 -167.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -56.27 -48.93 75.61 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 116.045 -0.525 . . . . 0.51 111.19 -174.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.96 -41.47 97.56 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 110.162 -0.31 . . . . 0.45 110.162 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.627 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 54.7 t80 -52.39 -62.57 1.55 Allowed 'General case' 0 CA--C 1.499 -1.01 0 N-CA-C 108.044 -1.095 . . . . 0.13 108.044 175.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.675 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.3 m-80 -61.35 -29.64 70.02 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 113.244 -1.798 . . . . 0.3 111.492 -175.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 m -74.15 -48.43 29.39 Favored 'General case' 0 N--CA 1.425 -1.708 0 CA-C-N 115.431 -0.804 . . . . 0.2 111.015 -176.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.726 HD12 ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -69.09 -36.84 78.01 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.07 -1.455 . . . . 0.53 107.07 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 33.3 t80 -57.01 -47.74 80.15 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 113.318 -1.765 . . . . 0.15 110.539 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -27.43 67.86 Favored 'General case' 0 CA--C 1.501 -0.922 0 CA-C-O 122.383 1.087 . . . . 0.52 108.915 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.643 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.38 -33.57 61.04 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 112.857 -1.974 . . . . 0.1 111.325 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.726 ' CE2' HD12 ' A' ' 31' ' ' LEU . 30.0 m-85 -59.94 -25.55 65.26 Favored 'General case' 0 CA--C 1.487 -1.466 0 N-CA-C 108.542 -0.91 . . . . 0.08 108.542 175.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 90.4 m-85 -91.12 127.14 36.43 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.082 -1.417 . . . . 0.11 108.928 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.691 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.6 p -60.35 -26.16 66.39 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 113.361 -1.745 . . . . 0.17 110.628 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.587 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 9.0 p30 -147.5 154.44 40.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.191 -0.913 . . . . 1.52 108.544 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.0 p -72.44 -1.87 17.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.108 0.781 . . . . 0.36 113.108 -171.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.587 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 19.3 m120 -74.56 -15.1 60.86 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.878 -0.786 . . . . 1.15 108.878 170.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.8 mtpt 54.62 43.53 30.07 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.371 -1.286 . . . . 0.66 110.603 175.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.789 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.9 p -103.62 -1.71 27.78 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 112.36 -2.2 . . . . 0.21 109.961 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.105 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -158.37 147.03 18.84 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 114.404 -1.271 . . . . 0.1 109.597 -168.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.785 HD22 HG22 ' A' ' 82' ' ' ILE . 1.0 OUTLIER -127.13 139.02 53.26 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 113.865 1.061 . . . . 0.09 113.865 -173.046 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HB3' ' HG2' ' A' ' 48' ' ' GLN . 7.0 mmtm -87.76 131.35 34.53 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.49 -1.686 . . . . 1.95 109.591 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -79.02 -21.84 46.33 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.68 -1.145 . . . . 1.78 111.634 -171.187 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 10.1 p -68.18 -28.51 67.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.359 0.599 . . . . 1.32 110.502 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 9.1 mm100 -75.44 -24.97 57.1 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.514 -0.766 . . . . 0.82 111.118 -178.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.571 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.0 m-30 -54.82 -27.07 39.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.837 0.351 . . . . 0.13 111.81 -177.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.32 -22.18 65.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.691 0.758 . . . . 0.41 109.619 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 6.0 mttt -98.28 8.31 45.0 Favored 'General case' 0 C--O 1.203 -1.343 0 CA-C-N 114.48 -1.237 . . . . 1.47 110.933 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.683 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -63.94 -36.87 85.36 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 121.183 -0.948 . . . . 0.09 111.314 179.117 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -73.88 -16.79 61.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.709 0.766 . . . . 1.25 109.247 173.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.701 HE22 HD23 ' A' ' 31' ' ' LEU . 0.9 OUTLIER -79.22 -43.29 24.12 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 114.978 -1.01 . . . . 1.24 110.264 173.294 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -63.73 -25.28 68.12 Favored 'General case' 0 C--N 1.309 -1.154 0 N-CA-C 108.352 -0.981 . . . . 0.1 108.352 174.46 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.658 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 2.5 tptp -78.55 -31.09 47.24 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.62 -1.173 . . . . 0.82 108.744 172.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.671 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.7 -39.67 66.81 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.78 -1.1 . . . . 0.14 109.755 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.779 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.7 mt -70.18 -39.64 75.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 115.576 -0.738 . . . . 0.16 110.084 176.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.604 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.99 -35.73 81.66 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.367 -0.605 . . . . 0.11 109.367 170.192 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.711 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.77 -22.06 66.9 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.944 0.878 . . . . 0.66 109.391 173.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.597 ' HE2' HD23 ' A' ' 58' ' ' LEU . 24.8 mtmt -84.48 -16.59 41.95 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.595 -1.184 . . . . 1.92 110.147 175.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.779 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -89.62 -22.88 22.1 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 114.53 -1.214 . . . . 0.14 107.773 175.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 11.8 mt-10 -46.06 129.72 9.89 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 113.45 -1.705 . . . . 1.75 111.961 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 -10.58 72.84 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 120.504 -0.855 . . . . 0.26 111.556 -178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.544 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 3.1 m -110.49 170.45 8.08 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.312 -0.625 . . . . 0.27 109.312 178.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 16.8 ptp180 -76.61 -29.89 56.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.229 0.538 . . . . 3.05 110.784 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.779 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.3 mp0 -56.32 -37.46 69.97 Favored 'General case' 0 CA--C 1.488 -1.425 0 CA-C-N 115.247 -0.888 . . . . 2.51 110.422 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 28.7 t-80 -40.36 -46.59 2.39 Favored 'General case' 0 C--O 1.19 -2.037 0 CA-C-N 113.407 -1.724 . . . . 0.17 112.668 175.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.7 m -57.1 -53.25 60.25 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-O 122.831 1.301 . . . . 0.22 111.162 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.791 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.63 -44.38 90.68 Favored 'General case' 0 CA--C 1.474 -1.949 0 CA-C-N 111.801 -2.454 . . . . 0.21 107.25 -174.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.435 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.12 -21.11 36.86 Favored 'General case' 0 C--N 1.275 -2.637 0 CA-C-N 111.776 -2.466 . . . . 0.11 111.183 -172.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.664 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.3 tttm -76.0 -34.35 59.73 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 106.452 -1.684 . . . . 1.35 106.452 171.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 77' ' ' SER . 19.8 m -76.98 -18.4 58.24 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.507 -1.679 . . . . 1.18 109.912 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.791 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.5 mtpp -84.67 -54.1 4.94 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-O 121.942 0.877 . . . . 1.02 109.712 170.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.425 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 17.7 t80 -51.43 -56.38 13.59 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.26 -1.791 . . . . 0.25 110.584 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.664 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.82 -34.45 77.94 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.757 1.265 . . . . 0.65 107.831 -170.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 30.2 t -64.02 -56.12 17.35 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 112.112 -2.313 . . . . 0.1 108.559 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.695 HD11 ' CG ' ' A' ' 35' ' ' PHE . 1.0 OUTLIER -66.09 -36.62 83.66 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.021 -1.899 . . . . 0.04 109.148 -175.226 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.682 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.26 -37.36 85.3 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-N 113.271 -1.786 . . . . 0.07 110.147 179.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 119' ' ' THR . 55.0 m -73.1 -37.4 66.73 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.437 -0.801 . . . . 0.07 110.661 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.755 ' HA ' HG21 ' A' ' 119' ' ' THR . 44.5 mt-30 -67.74 -39.89 84.21 Favored 'General case' 0 N--CA 1.411 -2.383 0 N-CA-C 109.46 -0.57 . . . . 0.09 109.46 -177.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.785 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.11 -46.87 33.09 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.391 0 C-N-CA 117.739 -1.584 . . . . 0.06 109.259 174.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.682 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.6 -32.06 58.1 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.083 0.468 . . . . 0.95 112.147 179.553 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.629 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.01 -49.07 69.07 Favored 'General case' 0 CA--C 1.476 -1.9 0 CA-C-N 115.194 -0.912 . . . . 0.05 110.136 173.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.781 HG23 ' HB ' ' A' ' 97' ' ' ILE . 71.8 mt -58.6 -45.36 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.725 0 CA-C-N 113.527 -1.67 . . . . 0.05 107.971 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.633 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -58.76 -50.49 73.74 Favored 'General case' 0 N--CA 1.407 -2.609 0 CA-C-N 113.93 -1.487 . . . . 0.09 108.515 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -49.49 -56.87 8.31 Favored 'General case' 0 CA--C 1.492 -1.285 0 O-C-N 124.981 1.426 . . . . 0.4 110.467 -178.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -76.05 -40.13 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-N 115.17 -0.923 . . . . 0.05 110.097 -173.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.702 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 24.1 m-20 -57.71 -30.17 65.31 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-O 122.17 0.986 . . . . 0.09 109.995 172.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.33 -12.54 60.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 113.422 -1.717 . . . . 0.12 109.721 -176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.716 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.5 mm-40 -90.48 -17.71 26.62 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.925 -1.489 . . . . 0.25 109.279 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.725 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 27.5 m-85 -98.63 157.68 16.1 Favored 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 121.894 0.854 . . . . 0.12 111.493 175.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.692 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 11.5 mt-10 -61.87 -27.5 68.84 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.479 -1.691 . . . . 0.45 109.217 176.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 12.1 mtpp -145.62 144.27 22.15 Favored Pre-proline 0 CA--C 1.513 -0.48 0 N-CA-C 107.238 -1.393 . . . . 2.94 107.238 173.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.702 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 80.4 Cg_exo -46.9 138.6 15.33 Favored 'Trans proline' 0 CA--C 1.49 -1.7 0 C-N-CA 124.606 3.537 . . . . 0.14 113.294 -174.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.861 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.43 53.75 1.97 Allowed 'General case' 0 N--CA 1.411 -2.416 0 C-N-CA 117.003 -1.879 . . . . 0.06 111.431 172.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.781 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.88 97.94 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.479 -1.764 0 N-CA-C 105.022 -2.214 . . . . 0.1 105.022 150.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' ASP . 22.5 m -132.94 116.66 27.1 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.902 0 C-N-CA 119.339 -0.944 . . . . 0.14 109.412 -175.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.691 ' C ' HG21 ' A' ' 37' ' ' THR . 33.3 t70 74.76 37.15 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.101 -1.409 . . . . 0.53 109.027 -170.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.105 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.6 5.82 39.27 Favored Glycine 0 CA--C 1.501 -0.833 0 CA-C-N 115.075 -0.966 . . . . 0.1 113.062 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.5 p -128.97 136.83 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 CA-C-O 122.519 1.152 . . . . 0.15 110.037 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.861 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.7 OUTLIER -67.53 151.21 47.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 113.059 -1.882 . . . . 0.11 111.919 -175.647 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.6 OUTLIER -103.9 94.09 5.23 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.84 -1.527 . . . . 0.48 107.468 175.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.827 ' HA ' HD21 ' A' ' 134' ' ' LEU . 2.2 p -67.06 -13.83 62.31 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 122.544 1.164 . . . . 0.2 109.744 -178.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -83.8 -3.86 58.19 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 112.736 -2.029 . . . . 0.9 109.555 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -71.5 176.81 4.41 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 113.67 -1.605 . . . . 0.2 111.19 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.692 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 20.6 mmmt -135.83 94.5 3.08 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 114.064 -1.425 . . . . 1.99 111.522 -168.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.459 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.61 100.2 0.26 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.308 -0.627 . . . . 0.13 109.308 -179.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.1 mtmt -45.21 162.93 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 114.47 -1.241 . . . . 0.26 113.351 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -70.23 0.38 6.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.294 -0.867 . . . . 0.29 110.157 174.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 109' ' ' LYS . 30.8 t70 -114.69 -17.96 11.51 Favored 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 114.505 -1.225 . . . . 1.51 108.797 -175.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.716 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.58 118.9 1.71 Allowed 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.542 1.163 . . . . 0.15 112.213 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 43.4 tttt -136.76 100.49 4.33 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 112.573 -2.103 . . . . 2.22 108.471 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.667 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.5 m-85 -89.25 156.54 18.68 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 113.91 1.078 . . . . 0.15 113.91 -168.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -131.52 136.12 47.62 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.193 -1.821 . . . . 0.2 108.662 177.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -66.96 73.57 0.1 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 122.654 1.216 . . . . 1.36 108.828 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.509 HG21 ' CB ' ' A' ' 84' ' ' ALA . 9.3 mt -77.46 115.1 18.82 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.635 0 CA-C-N 113.499 -1.682 . . . . 0.18 111.641 -175.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -106.96 102.22 11.59 Favored 'General case' 0 CA--C 1.487 -1.451 0 CA-C-N 114.352 -1.294 . . . . 1.87 110.781 169.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 81' ' ' GLN . 71.2 p -70.67 -18.2 62.84 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.3 -2.227 . . . . 0.16 109.078 175.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 97.57 -19.95 52.63 Favored Glycine 0 N--CA 1.426 -1.993 0 CA-C-N 114.32 -1.309 . . . . 0.18 110.823 -168.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.468 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 61.0 t-20 -86.62 90.53 8.28 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.606 -1.257 . . . . 0.45 107.606 172.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.838 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 88.8 m -49.51 -55.29 13.87 Favored 'General case' 0 C--O 1.205 -1.266 0 N-CA-C 112.847 0.684 . . . . 0.26 112.847 -176.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.789 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.6 mp0 -53.37 -38.98 63.84 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 123.689 0.796 . . . . 1.66 110.704 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.738 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 12.1 tp -72.28 -43.95 63.51 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 114.64 -1.164 . . . . 0.09 109.387 175.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.574 ' HA ' HD12 ' A' ' 128' ' ' LEU . 95.4 m-20 -58.03 -31.38 66.94 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.335 -0.848 . . . . 1.49 108.964 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.838 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.3 mtpt -76.48 -21.92 55.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.63 -1.168 . . . . 1.29 112.322 175.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 38.3 t -94.4 -29.07 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 N-CA-C 108.953 -0.758 . . . . 0.09 108.953 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 52.9 mt -55.62 -48.2 75.32 Favored 'General case' 0 CA--C 1.5 -0.954 0 N-CA-C 106.491 -1.67 . . . . 0.07 106.491 171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -58.36 -46.97 85.28 Favored 'General case' 0 CA--C 1.497 -1.08 0 CA-C-N 110.672 -2.967 . . . . 0.37 111.463 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.655 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -46.31 -43.52 15.91 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 112.307 -2.224 . . . . 1.66 110.12 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.725 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.98 -50.46 41.42 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 114.195 -1.366 . . . . 0.06 109.829 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.667 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.93 -22.23 6.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.327 -0.852 . . . . 0.09 111.265 176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 3.7 t -80.63 -16.78 53.2 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.183 -0.917 . . . . 1.33 109.672 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.6 mp -82.22 -27.8 32.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.85 -1.068 . . . . 0.1 108.911 169.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.639 -1.089 . . . . 1.19 112.543 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.739 0 N-CA-C 111.81 -0.516 . . . . 22.48 111.81 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -136.38 139.14 42.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.721 0.296 . . . . 23.33 110.223 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.4 tpt -106.17 124.06 48.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.314 -0.403 . . . . 22.11 110.256 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -100.62 96.59 7.46 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.221 -0.445 . . . . 20.59 110.477 -177.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.0 t -102.53 -58.55 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.094 0.473 . . . . 18.37 110.339 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.27 70.28 0.3 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.608 -0.724 . . . . 16.65 109.902 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 17.53 110.461 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m 69.87 133.67 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.926 0.766 . . . . 15.09 112.635 171.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 4.8 m -75.93 153.6 36.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.628 -0.714 . . . . 13.75 110.306 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 9' ' ' THR . 27.8 tptp 75.01 2.57 4.01 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.352 0.661 . . . . 14.58 110.306 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 70.16 147.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.11 -0.95 . . . . 13.16 111.727 178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.0 mt -85.03 94.03 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.68 -0.691 . . . . 10.1 110.14 178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.62 -77.0 0.53 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.861 0.362 . . . . 10.66 111.089 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -94.71 -81.53 0.39 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.006 -0.543 . . . . 7.42 111.648 -175.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.9 m 55.82 41.03 30.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.424 0.631 . . . . 6.06 109.961 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -80.39 -57.47 3.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 6.06 111.129 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.2 m -140.76 -166.24 2.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.881 0.372 . . . . 2.91 111.06 -178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.573 ' OG1' ' HA ' ' A' ' 65' ' ' SER . 2.9 p -68.18 172.1 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.709 . . . . 1.44 112.027 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.544 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 91.9 m -128.78 -71.95 0.62 Allowed 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.736 -0.665 . . . . 1.25 110.511 173.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . 175.4 -173.21 0.08 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 124.414 1.071 . . . . 0.39 112.114 176.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.503 ' HB2' ' OD1' ' A' ' 24' ' ' ASP . 18.7 m-80 -134.63 148.4 50.38 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 112.91 -1.95 . . . . 0.43 106.152 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.604 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.2 mp0 -79.75 -13.09 59.69 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 119.862 -0.735 . . . . 1.0 111.496 -176.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.7 t -82.47 -9.6 59.36 Favored 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 107.625 -1.25 . . . . 1.36 107.625 171.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.617 ' HB3' HD13 ' A' ' 62' ' ' LEU . 94.7 m-20 -98.6 -44.06 6.6 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 114.282 -1.326 . . . . 1.27 109.385 176.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.604 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 53.8 t -86.9 -53.5 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.182 -1.372 . . . . 1.01 113.145 -170.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -54.28 -52.96 59.76 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.562 0.539 . . . . 0.51 111.181 -174.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -66.23 -36.85 84.1 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 109.952 -0.388 . . . . 0.45 109.952 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.675 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 72.5 t80 -55.26 -64.79 0.73 Allowed 'General case' 0 CA--C 1.496 -1.105 0 N-CA-C 108.053 -1.091 . . . . 0.13 108.053 174.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.549 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 11.8 m-80 -61.02 -26.34 67.55 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 113.204 -1.816 . . . . 0.3 111.194 -174.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 m -81.79 -46.46 14.16 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 115.65 -0.704 . . . . 0.2 110.801 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.673 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 24.6 tp -68.72 -33.34 73.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.112 -1.44 . . . . 0.53 107.112 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.707 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 36.3 t80 -63.15 -49.2 75.27 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 112.977 -1.919 . . . . 0.15 110.723 176.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -25.17 68.08 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 122.535 1.159 . . . . 0.52 108.785 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.44 -32.75 54.75 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.633 -2.076 . . . . 0.1 112.031 -174.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.73 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.4 m-85 -61.64 -22.67 65.47 Favored 'General case' 0 CA--C 1.49 -1.338 0 N-CA-C 108.653 -0.869 . . . . 0.08 108.653 176.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.653 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.6 m-85 -93.58 125.59 38.27 Favored 'General case' 0 N--CA 1.424 -1.768 0 CA-C-N 114.587 -1.188 . . . . 0.11 109.301 178.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.694 HG21 ' C ' ' A' ' 99' ' ' ASP . 3.4 p -62.04 -22.75 65.99 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 113.585 -1.643 . . . . 0.17 110.332 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' A' ' 40' ' ' ASN . 27.5 p-10 -141.57 150.95 42.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.671 -1.15 . . . . 1.52 108.538 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 p -74.68 -1.81 23.42 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.846 -0.342 . . . . 0.36 111.223 -176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.613 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 18.9 m120 -73.81 -17.89 61.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.452 0.644 . . . . 1.15 109.291 169.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 55.03 41.67 31.61 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.248 -1.342 . . . . 0.66 110.673 175.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.515 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 55.9 p -108.98 2.29 21.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 112.656 -2.066 . . . . 0.21 109.235 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.44 143.43 19.95 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.292 -1.322 . . . . 0.1 109.546 -173.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.764 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -124.39 140.34 53.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 114.736 1.384 . . . . 0.09 114.736 -172.065 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.539 ' HG2' HG22 ' A' ' 37' ' ' THR . 18.8 mmmt -88.08 135.06 33.59 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 113.625 -1.625 . . . . 1.95 109.651 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -81.5 -29.93 33.46 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.144 -1.389 . . . . 1.78 112.497 -170.432 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.3 m -65.38 -24.25 67.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.292 0.568 . . . . 1.32 110.566 178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.547 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 11.0 mm100 -73.59 -24.15 60.03 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.015 -0.539 . . . . 0.82 111.822 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.588 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.8 m-30 -56.45 -24.46 45.71 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.184 0.439 . . . . 0.13 112.184 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.02 -19.91 56.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 122.106 0.955 . . . . 0.41 109.034 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -97.45 9.58 41.99 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.342 -1.299 . . . . 1.47 110.229 177.714 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.653 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.74 -40.46 92.17 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.296 -0.562 . . . . 0.09 110.426 176.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.0 t -67.36 -20.32 65.56 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.013 -0.736 . . . . 1.25 109.013 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.686 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -81.05 -37.75 28.53 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.345 -0.843 . . . . 1.24 110.207 175.354 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -66.51 -27.83 68.08 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.144 -1.058 . . . . 0.1 108.144 174.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.598 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.08 -30.07 55.31 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.476 -1.238 . . . . 0.82 108.621 173.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -71.03 -39.83 72.09 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.695 -1.139 . . . . 0.14 109.78 178.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.3 mt -72.46 -40.91 66.63 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-N 115.339 -0.846 . . . . 0.16 110.704 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.04 -36.85 82.84 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 108.996 -0.742 . . . . 0.11 108.996 169.496 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.693 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.05 -21.38 66.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.525 0.678 . . . . 0.66 110.151 172.318 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.2 mttt -83.04 -20.15 35.54 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.164 -0.926 . . . . 1.92 109.881 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.727 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.17 -22.75 25.12 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-N 114.237 -1.347 . . . . 0.14 107.557 177.597 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.693 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 8.3 mt-10 -48.53 124.95 8.94 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.207 -1.815 . . . . 1.75 111.595 174.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.99 -13.2 62.21 Favored Glycine 0 N--CA 1.429 -1.818 0 C-N-CA 120.404 -0.903 . . . . 0.26 111.283 -178.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.573 ' HA ' ' OG1' ' A' ' 18' ' ' THR . 0.8 OUTLIER -110.68 -177.75 3.31 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 110.113 -0.329 . . . . 0.27 110.113 177.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 20.6 ptt180 -85.71 -28.85 24.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.184 0.516 . . . . 3.05 110.268 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 4.4 mm-40 -56.68 -38.04 71.69 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-N 114.932 -1.031 . . . . 2.51 108.85 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.639 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 31.0 t-80 -40.29 -45.75 2.17 Favored 'General case' 0 C--O 1.193 -1.911 0 CA-C-N 113.318 -1.765 . . . . 0.17 112.571 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.0 m -57.3 -54.47 46.44 Favored 'General case' 0 C--N 1.295 -1.798 0 CA-C-O 122.815 1.293 . . . . 0.22 111.127 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.784 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.83 -44.42 89.87 Favored 'General case' 0 CA--C 1.476 -1.886 0 CA-C-N 112.029 -2.351 . . . . 0.21 107.248 -174.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.441 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.41 -21.43 38.94 Favored 'General case' 0 N--CA 1.405 -2.705 0 CA-C-N 111.659 -2.518 . . . . 0.11 111.036 -172.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.655 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.0 tttt -76.23 -34.75 59.21 Favored 'General case' 0 CA--C 1.474 -1.974 0 N-CA-C 106.372 -1.714 . . . . 1.35 106.372 171.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.449 ' O ' ' HB2' ' A' ' 77' ' ' SER . 44.7 m -75.43 -18.35 59.92 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 113.666 -1.607 . . . . 1.18 109.843 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.784 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.8 mtpp -84.11 -54.2 4.99 Favored 'General case' 0 CA--C 1.491 -1.315 0 CA-C-O 122.012 0.911 . . . . 1.02 109.588 170.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.517 ' HE2' ' HB2' ' A' ' 56' ' ' LYS . 16.5 t80 -52.33 -56.31 15.68 Favored 'General case' 0 N--CA 1.425 -1.684 0 CA-C-N 113.188 -1.824 . . . . 0.25 110.766 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.655 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.9 -33.54 75.92 Favored 'General case' 0 CA--C 1.498 -1.034 0 CA-C-O 122.908 1.337 . . . . 0.65 108.042 -170.236 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.584 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.2 t -64.77 -56.35 14.11 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.037 -2.347 . . . . 0.1 108.563 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.73 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.75 -37.28 85.93 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.157 -1.838 . . . . 0.04 109.226 -175.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.687 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.31 -35.84 82.22 Favored 'General case' 0 CA--C 1.488 -1.404 0 CA-C-N 113.416 -1.72 . . . . 0.07 110.048 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.453 HG22 HG22 ' A' ' 119' ' ' THR . 55.3 m -75.04 -37.87 61.59 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.413 -0.812 . . . . 0.07 110.622 179.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.78 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.3 mt-30 -67.2 -39.32 86.34 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 109.363 -0.606 . . . . 0.09 109.363 -177.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.764 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -76.32 -47.7 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 C-N-CA 117.845 -1.542 . . . . 0.06 109.468 174.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.687 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -53.81 -32.21 51.9 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.322 0.49 . . . . 0.95 112.322 179.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.69 -49.65 67.76 Favored 'General case' 0 CA--C 1.476 -1.873 0 CA-C-N 114.983 -1.008 . . . . 0.05 110.115 173.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.7 mt -58.66 -44.6 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.715 0 CA-C-N 113.426 -1.715 . . . . 0.05 108.055 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.64 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -59.28 -49.99 75.71 Favored 'General case' 0 N--CA 1.407 -2.578 0 CA-C-N 113.927 -1.488 . . . . 0.09 108.731 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 1.2 t70 -48.38 -58.93 3.9 Favored 'General case' 0 CA--C 1.493 -1.242 0 O-C-N 124.981 1.426 . . . . 0.4 109.892 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.74 -39.95 46.61 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.596 0 CA-C-N 114.752 -1.113 . . . . 0.05 110.373 -172.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.7 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.7 m-20 -58.77 -29.06 66.5 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 122.014 0.912 . . . . 0.09 109.883 172.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.4 -12.8 60.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.635 -1.621 . . . . 0.12 109.685 -176.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.686 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.8 mm-40 -89.54 -19.5 24.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 114.191 -1.368 . . . . 0.25 109.389 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.691 ' HZ ' ' O ' ' A' ' 131' ' ' ALA . 32.5 m-85 -98.1 157.77 15.94 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.993 0.901 . . . . 0.12 111.69 176.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.683 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 22.8 mt-10 -62.4 -26.54 68.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.334 -1.757 . . . . 0.45 109.173 176.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.2 mttm -147.3 143.59 18.34 Favored Pre-proline 0 CA--C 1.515 -0.377 0 N-CA-C 107.334 -1.358 . . . . 2.94 107.334 173.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.7 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 96.0 Cg_exo -46.89 138.96 14.92 Favored 'Trans proline' 0 CA--C 1.488 -1.808 0 C-N-CA 124.506 3.471 . . . . 0.14 113.419 -172.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.849 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.18 53.95 1.95 Allowed 'General case' 0 N--CA 1.409 -2.497 0 C-N-CA 116.912 -1.915 . . . . 0.06 111.498 172.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.54 98.08 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.478 -1.798 0 N-CA-C 105.34 -2.096 . . . . 0.1 105.34 149.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.7 m -132.66 112.41 18.81 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.888 0 C-N-CA 119.269 -0.972 . . . . 0.14 109.798 -175.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.694 ' C ' HG21 ' A' ' 37' ' ' THR . 25.9 t70 78.71 36.41 0.19 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 113.584 -1.644 . . . . 0.53 109.37 -173.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 72.03 3.52 56.48 Favored Glycine 0 CA--C 1.502 -0.722 0 CA-C-N 115.495 -0.775 . . . . 0.1 112.899 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.78 136.85 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-O 122.318 1.056 . . . . 0.15 109.933 178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.849 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.22 152.7 45.26 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-N 113.194 -1.821 . . . . 0.11 111.432 -176.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.483 ' O ' HD21 ' A' ' 134' ' ' LEU . 7.1 t0 -104.35 94.38 5.32 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.096 -1.411 . . . . 0.48 107.689 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.806 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.28 -11.61 59.7 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 123.006 1.384 . . . . 0.2 109.041 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.1 -8.52 59.44 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 112.134 -2.303 . . . . 0.9 109.599 179.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.642 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.96 -178.98 2.99 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 113.85 -1.523 . . . . 0.2 111.728 -176.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.683 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.0 mmmm -140.53 98.11 3.35 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 113.942 -1.481 . . . . 1.99 111.31 -169.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -66.6 101.31 0.77 Allowed 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.233 -0.655 . . . . 0.13 109.233 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.636 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 46.5 mtmt -45.48 167.76 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 114.499 -1.228 . . . . 0.26 113.902 -178.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 17.7 m -72.92 -0.78 14.58 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.076 -0.966 . . . . 0.29 110.173 173.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -116.91 -8.19 11.33 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.765 -1.107 . . . . 1.51 109.027 -177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.686 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -50.63 116.45 1.93 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.549 1.166 . . . . 0.15 111.181 171.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -138.02 100.6 4.2 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.657 -2.065 . . . . 2.22 107.824 178.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.703 ' CG ' HG23 ' A' ' 132' ' ' ILE . 83.8 m-85 -89.42 154.58 19.94 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 114.044 1.127 . . . . 0.15 114.044 -166.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.29 135.0 49.96 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.05 -1.886 . . . . 0.2 107.926 174.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.21 70.13 0.81 Allowed 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 122.181 0.991 . . . . 1.36 109.154 177.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.502 HG21 ' CB ' ' A' ' 84' ' ' ALA . 13.4 mt -70.98 122.51 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 CA-C-N 113.429 -1.714 . . . . 0.18 112.298 -172.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -108.33 116.1 31.34 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-N 114.405 -1.27 . . . . 1.87 110.179 167.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.7 p -85.74 -18.3 33.42 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 112.917 -1.947 . . . . 0.16 108.364 175.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 98.93 -20.08 51.73 Favored Glycine 0 N--CA 1.427 -1.934 0 CA-C-N 114.133 -1.394 . . . . 0.18 111.091 -169.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 49.2 t30 -88.01 87.53 7.37 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.385 -0.598 . . . . 0.45 109.385 178.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.794 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.7 m -44.65 -60.17 2.13 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 113.744 1.016 . . . . 0.26 113.744 -169.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.8 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.23 -38.38 57.87 Favored 'General case' 0 CA--C 1.504 -0.802 0 O-C-N 123.303 0.377 . . . . 1.66 110.241 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 16.4 tp -68.97 -46.21 68.69 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.207 -0.664 . . . . 0.09 109.207 176.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.585 ' HA ' HD12 ' A' ' 128' ' ' LEU . 94.9 m-20 -56.18 -31.96 63.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.237 -0.892 . . . . 1.49 108.853 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.794 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.2 mtpp -78.28 -23.73 47.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.57 -1.195 . . . . 1.29 112.938 175.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.8 HG23 ' O ' ' A' ' 123' ' ' GLU . 44.9 t -91.34 -29.35 4.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 108.81 -0.811 . . . . 0.09 108.81 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 62.2 mt -55.15 -48.69 73.36 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 106.433 -1.691 . . . . 0.07 106.433 171.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.44 -47.49 83.82 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 110.542 -3.026 . . . . 0.37 111.51 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.65 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.56 -45.25 9.31 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.273 -2.239 . . . . 1.66 110.099 178.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.691 ' O ' ' HZ ' ' A' ' 92' ' ' PHE . . . -69.1 -51.95 33.31 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.915 -1.493 . . . . 0.06 109.866 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.703 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.41 -25.37 4.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.197 0 CA-C-N 115.213 -0.903 . . . . 0.09 111.526 175.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 72.9 m -81.42 -13.84 57.8 Favored 'General case' 0 N--CA 1.414 -2.244 0 CA-C-N 114.978 -1.01 . . . . 1.33 110.067 -177.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 104' ' ' THR . 8.0 mp -80.49 -28.73 37.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.801 -1.09 . . . . 0.1 108.746 168.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.79 -1.006 . . . . 1.19 112.377 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.693 0 N-CA-C 111.845 -0.502 . . . . 22.48 111.845 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -90.28 -30.64 17.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.905 0.383 . . . . 23.33 110.335 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.0 mtt -138.42 -72.48 0.41 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.325 -0.398 . . . . 22.11 110.868 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 52.4 56.88 7.06 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.408 0.623 . . . . 20.59 110.394 -175.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.3 m -112.84 38.07 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.348 -0.842 . . . . 18.37 110.542 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -137.33 39.55 2.47 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.633 -0.712 . . . . 16.65 110.236 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -93.94 -6.74 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.602 -0.726 . . . . 17.53 110.944 -177.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.9 m -85.03 54.92 3.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.326 0.584 . . . . 15.09 109.863 177.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.2 p -81.22 154.92 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.581 -0.736 . . . . 13.75 111.872 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -99.4 13.2 34.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.566 -0.743 . . . . 14.58 110.129 178.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -96.68 159.86 14.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.818 -0.628 . . . . 13.16 109.375 175.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.3 mt -85.64 104.53 13.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.775 -0.454 . . . . 10.1 109.775 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -124.75 166.42 16.22 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.128 -0.487 . . . . 10.66 110.36 -177.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 56.4 m 69.48 125.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 123.81 0.694 . . . . 7.42 110.799 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t 65.69 68.21 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.252 0.549 . . . . 6.06 110.289 -178.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -66.58 131.95 47.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 6.06 109.828 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.6 m -75.86 178.47 6.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.327 -0.397 . . . . 2.91 111.143 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.2 p -51.61 135.36 28.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.686 -0.688 . . . . 1.44 111.977 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.58 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 50.3 m -127.0 147.75 50.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.2 0.524 . . . . 1.25 110.205 177.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.676 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -76.76 169.59 18.02 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 122.339 1.066 . . . . 0.39 111.612 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 10.7 m-80 -107.9 145.09 34.23 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.113 -1.858 . . . . 0.43 106.634 -176.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.626 HE21 HG22 ' A' ' 25' ' ' VAL . 1.2 mp0 -69.81 -14.19 62.64 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 119.237 0.926 . . . . 1.0 111.25 -176.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.3 p -79.48 -7.44 58.44 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 108.174 -1.047 . . . . 1.36 108.174 170.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HB3' HD13 ' A' ' 62' ' ' LEU . 82.0 m-20 -98.75 -49.25 4.65 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.532 -1.213 . . . . 1.27 108.411 174.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.626 HG22 HE21 ' A' ' 22' ' ' GLN . 1.7 m -91.22 -41.24 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.97 0 CA-C-N 114.874 -1.057 . . . . 1.01 113.54 -166.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.94 -49.83 74.57 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 121.063 -0.255 . . . . 0.51 110.528 -174.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.58 -36.18 83.0 Favored 'General case' 0 CA--C 1.5 -0.974 0 N-CA-C 109.588 -0.523 . . . . 0.45 109.588 177.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.649 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 66.2 t80 -54.8 -64.29 0.88 Allowed 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.083 -1.08 . . . . 0.13 108.083 174.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.591 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 10.2 m-80 -59.86 -27.61 66.81 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.335 -1.757 . . . . 0.3 111.38 -175.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.9 m -81.03 -45.68 16.18 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 115.54 -0.754 . . . . 0.2 110.929 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.686 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 15.0 tp -70.62 -31.23 68.12 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 107.322 -1.362 . . . . 0.53 107.322 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.708 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 30.2 t80 -64.89 -47.06 79.17 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.033 -1.894 . . . . 0.15 110.443 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -24.38 67.67 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 122.401 1.096 . . . . 0.52 108.867 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.0 -32.75 57.43 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 112.953 -1.93 . . . . 0.1 111.665 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.741 ' CG ' HD11 ' A' ' 78' ' ' LEU . 39.7 m-85 -62.51 -20.91 65.08 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-O 121.486 0.66 . . . . 0.08 109.273 176.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.603 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 82.7 m-85 -95.15 127.46 41.22 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.701 -1.136 . . . . 0.11 109.519 178.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.689 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -61.95 -22.94 66.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 113.704 -1.589 . . . . 0.17 110.471 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -139.77 158.75 43.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.23 -0.895 . . . . 1.52 108.973 177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.0 p -76.36 0.9 17.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.05 0.452 . . . . 0.36 110.768 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 42' ' ' THR . 16.2 m120 -75.27 -18.81 59.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.732 0.777 . . . . 1.15 109.117 170.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.484 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.0 mtpt 53.63 40.15 31.07 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-N 113.956 -1.474 . . . . 0.66 110.854 175.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.483 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 58.2 p -107.24 0.92 23.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 112.881 -1.963 . . . . 0.21 109.52 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.013 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.35 146.48 22.64 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.303 -1.317 . . . . 0.1 109.406 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.02 140.9 52.5 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 114.671 1.36 . . . . 0.09 114.671 -172.153 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 37' ' ' THR . 0.9 OUTLIER -88.63 133.31 34.23 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 113.567 -1.651 . . . . 1.95 109.369 177.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.9 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 9.9 m120 -85.72 -24.05 27.11 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.296 -1.32 . . . . 1.78 111.477 -168.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 m -67.12 -26.27 66.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.897 -0.592 . . . . 1.32 110.348 175.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 15.1 mm100 -73.3 -23.34 60.26 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.935 -0.575 . . . . 0.82 111.613 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.472 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 5.0 m-30 -56.31 -24.66 45.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.792 0.329 . . . . 0.13 111.71 -176.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -71.62 -23.37 61.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.862 0.839 . . . . 0.41 109.374 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.591 ' HD2' HD11 ' A' ' 31' ' ' LEU . 3.4 mttt -95.67 7.22 46.9 Favored 'General case' 0 C--O 1.211 -0.957 0 CA-C-N 114.496 -1.229 . . . . 1.47 110.381 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.49 -38.94 91.24 Favored 'General case' 0 C--N 1.314 -0.936 0 C-N-CA 120.075 -0.65 . . . . 0.09 110.553 178.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 m -70.75 -18.72 62.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 1.25 109.476 173.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.707 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.3 OUTLIER -81.04 -37.7 28.64 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.303 -0.862 . . . . 1.24 110.098 173.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.528 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.18 -27.45 67.28 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.979 -1.119 . . . . 0.1 107.979 175.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.617 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.8 tptp -77.81 -28.68 50.42 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 114.378 -1.283 . . . . 0.82 108.749 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -72.91 -39.92 65.92 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 114.625 -1.17 . . . . 0.14 109.772 179.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.778 ' O ' HD22 ' A' ' 62' ' ' LEU . 11.1 mt -72.11 -40.4 68.19 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 115.303 -0.862 . . . . 0.16 110.483 176.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.643 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -62.27 -36.74 83.02 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.199 -0.667 . . . . 0.11 109.199 169.76 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.672 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.84 -22.49 66.94 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.648 0.737 . . . . 0.66 110.075 172.429 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG3' ' O ' ' A' ' 57' ' ' THR . 36.5 mtpt -81.3 -21.23 39.44 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.951 -1.022 . . . . 1.92 109.863 174.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.3 OUTLIER -85.93 -24.75 26.46 Favored 'General case' 0 CA--C 1.491 -1.292 0 CA-C-N 114.139 -1.391 . . . . 0.14 107.541 178.412 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.07 126.44 7.52 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.224 -1.807 . . . . 1.75 112.13 177.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.16 -15.71 62.8 Favored Glycine 0 N--CA 1.434 -1.462 0 CA-C-N 115.301 -0.863 . . . . 0.26 111.412 -178.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.552 ' HB3' ' N ' ' A' ' 20' ' ' ALA . 4.9 m -110.26 163.74 13.34 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.582 -0.525 . . . . 0.27 109.582 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.58 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 12.9 ptt180 -70.28 -26.88 64.01 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.348 0.499 . . . . 3.05 112.348 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 5.7 mm-40 -58.34 -38.68 77.66 Favored 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 121.427 0.632 . . . . 2.51 109.317 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.637 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 31.8 t-80 -40.89 -45.8 2.61 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 113.676 -1.602 . . . . 0.17 113.151 177.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 55.4 m -57.08 -53.54 56.96 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-O 123.079 1.418 . . . . 0.22 111.158 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.6 -44.6 86.12 Favored 'General case' 0 CA--C 1.475 -1.907 0 CA-C-N 111.567 -2.561 . . . . 0.21 107.221 -174.716 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.442 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -81.52 -21.38 38.62 Favored 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 111.697 -2.501 . . . . 0.11 111.139 -172.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.654 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.1 tttm -76.43 -34.14 58.78 Favored 'General case' 0 CA--C 1.474 -1.945 0 N-CA-C 106.233 -1.765 . . . . 1.35 106.233 171.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 77' ' ' SER . 33.6 t -76.21 -18.86 58.85 Favored 'General case' 0 N--CA 1.426 -1.671 0 CA-C-N 113.407 -1.724 . . . . 1.18 109.677 177.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.802 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 17.1 mtpp -83.86 -54.05 5.16 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.215 1.007 . . . . 1.02 109.857 170.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CB ' ' HG ' ' A' ' 59' ' ' LEU . 15.5 t80 -52.09 -56.31 15.23 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.108 -1.86 . . . . 0.25 110.776 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.654 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -64.02 -34.02 77.07 Favored 'General case' 0 CA--C 1.498 -1.05 0 CA-C-O 122.8 1.286 . . . . 0.65 107.864 -170.235 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.579 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.2 t -64.13 -55.81 19.26 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 112.104 -2.316 . . . . 0.1 108.578 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -65.95 -36.82 84.38 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 113.107 -1.861 . . . . 0.04 109.224 -175.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.688 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.07 -34.02 77.12 Favored 'General case' 0 CA--C 1.489 -1.373 0 CA-C-N 113.249 -1.796 . . . . 0.07 110.177 179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 119' ' ' THR . 53.4 m -76.02 -37.92 57.84 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 115.438 -0.801 . . . . 0.07 110.6 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.693 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.0 mt-30 -66.78 -39.86 87.97 Favored 'General case' 0 N--CA 1.409 -2.486 0 N-CA-C 109.271 -0.64 . . . . 0.09 109.271 -177.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -75.76 -47.54 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.345 0 C-N-CA 117.982 -1.487 . . . . 0.06 109.379 174.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.688 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -54.43 -30.89 53.99 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.23 0.538 . . . . 0.95 112.321 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.622 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -66.72 -49.12 67.06 Favored 'General case' 0 CA--C 1.477 -1.833 0 CA-C-N 114.939 -1.028 . . . . 0.05 110.052 173.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.767 HG23 ' HB ' ' A' ' 97' ' ' ILE . 74.3 mt -59.31 -43.59 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.632 0 CA-C-N 113.682 -1.599 . . . . 0.05 108.128 179.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.624 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.65 -51.67 68.79 Favored 'General case' 0 N--CA 1.408 -2.572 0 CA-C-N 114.19 -1.368 . . . . 0.09 108.255 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -46.66 -59.41 3.04 Favored 'General case' 0 CA--C 1.49 -1.343 0 O-C-N 124.877 1.361 . . . . 0.4 109.797 -178.676 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -74.15 -41.53 51.66 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 CA-C-N 114.391 -1.277 . . . . 0.05 110.414 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 21.5 m-20 -58.32 -29.73 66.14 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-O 121.994 0.902 . . . . 0.09 110.138 173.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -13.93 61.02 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.605 -1.634 . . . . 0.12 109.354 -176.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.721 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 20.7 mm-40 -88.35 -20.06 25.84 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.148 -1.387 . . . . 0.25 109.694 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.718 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 36.6 m-85 -97.13 156.93 16.18 Favored 'General case' 0 CA--C 1.497 -1.088 0 CA-C-O 122.056 0.931 . . . . 0.12 111.95 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.695 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 8.5 mt-10 -61.21 -25.83 67.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.121 -1.854 . . . . 0.45 109.466 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.59 144.03 17.98 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 114.496 -1.229 . . . . 2.94 109.17 169.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.708 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 67.1 Cg_exo -46.0 137.2 13.4 Favored 'Trans proline' 0 CA--C 1.487 -1.863 0 C-N-CA 124.485 3.456 . . . . 0.14 113.316 -173.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.891 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.99 53.73 1.96 Allowed 'General case' 0 N--CA 1.408 -2.529 0 C-N-CA 117.071 -1.852 . . . . 0.06 111.487 174.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.767 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -147.93 97.96 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.905 0 N-CA-C 104.656 -2.349 . . . . 0.1 104.656 149.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.9 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 20.9 m -131.49 110.13 17.01 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.883 0 C-N-CA 119.007 -1.077 . . . . 0.14 110.183 -175.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.689 ' C ' HG21 ' A' ' 37' ' ' THR . 13.3 t70 77.24 40.99 0.16 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.378 -1.737 . . . . 0.53 109.437 -171.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.013 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 69.12 3.07 35.27 Favored Glycine 0 CA--C 1.503 -0.678 0 CA-C-N 115.366 -0.834 . . . . 0.1 113.039 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -128.9 135.28 62.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-O 122.542 1.163 . . . . 0.15 110.516 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.891 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.1 44.48 Favored 'General case' 0 C--N 1.288 -2.068 0 CA-C-N 113.075 -1.875 . . . . 0.11 111.703 -176.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.51 ' O ' HD21 ' A' ' 134' ' ' LEU . 0.8 OUTLIER -105.53 94.6 5.3 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 113.984 -1.462 . . . . 0.48 107.787 174.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.811 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.7 p -68.01 -11.97 59.92 Favored 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 122.523 1.154 . . . . 0.2 110.138 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -87.86 0.02 56.37 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.088 -1.869 . . . . 0.9 109.62 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.583 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -72.95 -179.95 3.44 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.673 -1.603 . . . . 0.2 111.149 178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.695 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.1 mmmt -139.34 96.65 3.13 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-N 114.619 -1.173 . . . . 1.99 111.732 -171.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.531 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.07 101.96 0.25 Allowed 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.94 -0.763 . . . . 0.13 108.94 178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.632 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.4 mtmt -46.3 165.91 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.592 -1.185 . . . . 0.26 113.169 -178.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.6 m -73.66 0.79 11.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.522 -0.763 . . . . 0.29 110.178 174.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.46 -15.16 12.09 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.602 -1.181 . . . . 1.51 108.763 -178.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.721 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -47.09 116.94 1.52 Allowed 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.426 1.108 . . . . 0.15 111.924 173.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -135.85 102.33 5.03 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.068 -1.878 . . . . 2.22 108.274 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.681 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.3 m-85 -89.53 156.75 18.42 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.18 1.178 . . . . 0.15 114.18 -167.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.4 p -130.58 134.57 47.11 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 112.954 -1.93 . . . . 0.2 108.039 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.48 69.43 0.6 Allowed 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 122.222 1.01 . . . . 1.36 108.947 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.435 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.3 mt -68.53 120.94 16.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 113.341 -1.754 . . . . 0.18 112.503 -171.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.443 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 27.2 mmmt -100.58 112.71 25.12 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 114.378 -1.283 . . . . 1.87 111.504 168.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 81' ' ' GLN . 56.3 p -88.79 -17.28 30.12 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-N 113.208 -1.814 . . . . 0.16 108.571 174.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.4 -12.66 69.17 Favored Glycine 0 N--CA 1.423 -2.182 0 CA-C-N 114.063 -1.426 . . . . 0.18 111.282 -170.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 46.1 t30 -93.17 86.37 5.34 Favored 'General case' 0 C--O 1.215 -0.712 0 N-CA-C 109.436 -0.579 . . . . 0.45 109.436 175.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.817 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 24.8 m -44.03 -60.57 1.8 Allowed 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 113.851 1.056 . . . . 0.26 113.851 -169.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.815 ' O ' HG23 ' A' ' 127' ' ' VAL . 0.9 OUTLIER -52.84 -35.57 57.48 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.061 0.226 . . . . 1.66 110.477 -178.591 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 15.0 tp -70.63 -46.69 62.84 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 109.173 -0.677 . . . . 0.09 109.173 175.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.602 ' HA ' HD12 ' A' ' 128' ' ' LEU . 97.3 m-20 -54.33 -32.69 57.27 Favored 'General case' 0 N--CA 1.441 -0.875 0 O-C-N 124.138 0.899 . . . . 1.49 108.978 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.817 ' HG3' ' O ' ' A' ' 122' ' ' THR . 20.5 mtpp -81.35 -18.17 46.55 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.462 -1.244 . . . . 1.29 112.897 176.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.7 t -94.79 -29.51 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 108.911 -0.774 . . . . 0.09 108.911 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 65.0 mt -54.84 -48.76 72.45 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.243 -1.762 . . . . 0.07 106.243 171.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -47.81 82.06 Favored 'General case' 0 CA--C 1.494 -1.211 0 CA-C-N 110.442 -3.072 . . . . 0.37 111.503 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.6 ' HB3' HD22 ' A' ' 102' ' ' LEU . 3.8 mptt -44.75 -44.43 9.26 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 112.288 -2.233 . . . . 1.66 110.09 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.718 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -69.94 -52.26 25.97 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 113.986 -1.461 . . . . 0.06 109.686 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.681 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.04 -23.15 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.387 -0.824 . . . . 0.09 111.573 175.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 130' ' ' LYS . 21.1 m -80.93 -15.68 55.6 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 115.572 -0.74 . . . . 1.33 110.408 -178.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.811 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.72 -29.53 36.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.759 -1.109 . . . . 0.1 108.645 168.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.531 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.813 -0.993 . . . . 1.19 112.392 178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.999 -0.44 . . . . 22.48 111.999 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -93.07 72.38 4.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 23.33 110.781 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 mmt 58.12 40.89 24.67 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.83 -0.623 . . . . 22.11 111.603 178.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -150.46 101.5 2.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.572 -0.74 . . . . 20.59 109.166 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.61 132.21 25.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.338 -0.846 . . . . 18.37 112.286 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 57.39 40.12 27.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.302 -0.863 . . . . 16.65 112.203 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -85.77 -34.16 21.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.942 0.401 . . . . 17.53 110.146 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -147.35 124.72 11.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.142 -0.481 . . . . 15.09 110.634 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -144.3 168.65 19.58 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.006 -0.739 . . . . 13.75 109.006 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG3' ' H ' ' A' ' 11' ' ' GLU . 47.0 pttt -57.16 -65.09 0.68 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.332 0.11 . . . . 14.58 111.084 -178.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.587 ' H ' ' HG3' ' A' ' 10' ' ' LYS . 4.5 mm-40 -158.12 152.85 24.95 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.169 -0.678 . . . . 13.16 109.169 178.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.8 mt -112.82 73.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.23 0.538 . . . . 10.1 109.823 175.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -138.27 48.37 1.96 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.898 -0.592 . . . . 10.66 110.303 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 48.2 p -64.52 -66.57 0.53 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.683 -0.488 . . . . 7.42 109.683 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.9 m 50.03 42.36 24.61 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.693 0.62 . . . . 6.06 112.334 171.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -93.86 -40.59 10.08 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.475 0.655 . . . . 6.06 109.374 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.7 t -155.39 -72.32 0.12 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.034 -0.984 . . . . 2.91 108.593 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.692 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 5.6 p -154.83 145.8 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.945 -1.025 . . . . 1.44 109.003 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.482 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 12.5 m -136.81 22.17 3.09 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.658 1.218 . . . . 1.25 109.908 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.715 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . 67.41 -176.95 0.2 Allowed 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.245 -1.798 . . . . 0.39 111.827 176.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.439 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 11.4 m-80 -123.36 155.35 37.51 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.891 -1.504 . . . . 0.43 107.356 -176.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.636 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -76.89 -11.81 59.87 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 119.89 -0.724 . . . . 1.0 110.771 178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.5 m -82.19 -11.35 58.75 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.454 -0.943 . . . . 1.36 108.454 171.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.661 ' HB3' HD13 ' A' ' 62' ' ' LEU . 85.2 m-20 -97.95 -45.83 6.14 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 114.479 -1.237 . . . . 1.27 109.302 175.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.636 ' HB ' HE21 ' A' ' 22' ' ' GLN . 42.6 t -85.7 -50.4 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.094 0 CA-C-N 113.129 -1.85 . . . . 1.01 112.491 -167.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.576 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 14.6 t70 -56.2 -54.22 47.88 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.138 -0.483 . . . . 0.51 112.155 -173.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.04 -38.01 89.52 Favored 'General case' 0 CA--C 1.5 -0.942 0 N-CA-C 109.679 -0.489 . . . . 0.45 109.679 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.536 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 79.1 t80 -53.76 -63.81 1.03 Allowed 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 108.046 -1.094 . . . . 0.13 108.046 175.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' ND2' HG13 ' A' ' 25' ' ' VAL . 4.5 m-80 -57.71 -32.4 67.36 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 113.384 -1.735 . . . . 0.3 111.33 -176.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.7 m -78.82 -47.65 16.27 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-N 115.226 -0.897 . . . . 0.2 111.186 -173.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.685 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.1 tp -69.06 -31.03 69.51 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.413 -1.329 . . . . 0.53 107.413 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 43.7 t80 -65.33 -48.74 71.99 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.439 -1.71 . . . . 0.15 110.781 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -26.19 68.62 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-O 122.592 1.187 . . . . 0.52 108.837 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -73.94 -32.72 63.63 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 112.552 -2.113 . . . . 0.1 111.652 -175.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.731 ' CG ' HD11 ' A' ' 78' ' ' LEU . 41.1 m-85 -63.17 -20.16 65.15 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-O 121.362 0.601 . . . . 0.08 109.403 176.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.635 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.1 m-85 -95.29 128.0 41.78 Favored 'General case' 0 N--CA 1.426 -1.653 0 CA-C-N 114.955 -1.021 . . . . 0.11 109.984 179.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.69 HG21 ' C ' ' A' ' 99' ' ' ASP . 4.9 p -64.48 -24.49 67.63 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 113.628 -1.624 . . . . 0.17 110.194 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -139.39 143.99 37.95 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.975 -1.12 . . . . 1.52 107.975 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 41' ' ' LYS . 4.0 p -68.32 -7.44 31.07 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.869 0.322 . . . . 0.36 111.869 -176.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -70.52 -16.45 62.89 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.51 0.672 . . . . 1.15 109.524 170.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 36' ' ' TYR . 8.9 mtpt 56.73 42.92 26.1 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 114.268 -1.333 . . . . 0.66 110.313 176.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.62 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 35.7 p -108.34 3.78 23.78 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 112.326 -2.215 . . . . 0.21 109.9 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.076 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -159.21 150.58 20.23 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.648 -1.16 . . . . 0.1 109.099 -174.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.752 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.63 139.37 52.29 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 115.004 1.483 . . . . 0.09 115.004 -171.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.56 ' HG3' HG22 ' A' ' 37' ' ' THR . 54.7 mttt -85.96 123.12 30.93 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.015 -1.902 . . . . 1.95 109.25 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.654 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.4 m120 -76.14 -23.11 54.81 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.294 -0.866 . . . . 1.78 112.219 -172.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 8.1 t -69.73 -23.02 63.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.369 0.604 . . . . 1.32 109.993 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.487 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 10.2 mm100 -77.45 -22.95 50.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.691 -0.686 . . . . 0.82 111.317 -179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.52 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.2 m-30 -54.82 -25.6 29.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.13 111.911 -177.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.34 -22.45 61.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.876 0.846 . . . . 0.41 109.494 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.604 ' HB3' HD21 ' A' ' 31' ' ' LEU . 2.7 mttt -96.68 7.71 45.92 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 114.243 -1.344 . . . . 1.47 110.106 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -65.36 -39.95 92.95 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.346 -0.541 . . . . 0.09 110.503 177.57 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.0 m -65.94 -22.7 66.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.6 0.714 . . . . 1.25 109.218 172.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.678 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.5 OUTLIER -80.67 -37.62 30.5 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.027 -0.988 . . . . 1.24 110.268 176.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.558 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.12 -25.37 66.16 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 108.222 -1.029 . . . . 0.1 108.222 174.585 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.4 tptp -77.65 -32.96 53.59 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 114.555 -1.202 . . . . 0.82 108.526 172.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.696 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -67.66 -38.56 83.94 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.113 -0.949 . . . . 0.14 110.079 177.592 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.1 mt -74.42 -40.86 61.72 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.294 -0.867 . . . . 0.16 110.634 178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.629 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.65 -36.61 81.3 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.19 -0.67 . . . . 0.11 109.19 168.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.739 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.16 -24.27 67.08 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.706 0.765 . . . . 0.66 109.913 171.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.696 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.8 mttt -80.23 -20.39 44.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.995 -1.002 . . . . 1.92 109.736 175.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.58 -21.98 25.06 Favored 'General case' 0 CA--C 1.491 -1.295 0 CA-C-N 114.067 -1.424 . . . . 0.14 107.673 178.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.739 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 4.6 mt-10 -46.46 131.75 10.79 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 113.602 -1.635 . . . . 1.75 111.757 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.11 -10.79 71.61 Favored Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 115.358 -0.837 . . . . 0.26 111.675 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.595 ' HA ' ' CB ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -110.87 169.9 8.46 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.905 -0.406 . . . . 0.27 109.905 177.767 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.692 ' HB3' ' O ' ' A' ' 18' ' ' THR . 13.2 ptt180 -70.83 -34.55 71.82 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.193 0.52 . . . . 3.05 110.154 176.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.715 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.1 mm-40 -53.44 -38.1 63.22 Favored 'General case' 0 CA--C 1.49 -1.332 0 CA-C-N 114.378 -1.283 . . . . 2.51 109.219 -175.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.649 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 32.6 t-80 -41.28 -46.35 3.18 Favored 'General case' 0 C--O 1.192 -1.973 0 CA-C-N 112.76 -2.018 . . . . 0.17 113.103 176.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 45.1 m -59.06 -53.1 62.15 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-O 123.029 1.395 . . . . 0.22 110.842 -178.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.74 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.37 -42.8 87.45 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-N 111.706 -2.497 . . . . 0.21 107.355 -174.257 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -83.16 -18.68 38.58 Favored 'General case' 0 C--N 1.272 -2.789 0 CA-C-N 112.1 -2.318 . . . . 0.11 110.891 -174.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.572 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 28.4 tttt -76.39 -36.64 57.98 Favored 'General case' 0 CA--C 1.473 -2.006 0 N-CA-C 106.4 -1.704 . . . . 1.35 106.4 170.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' A' ' 77' ' ' SER . 79.2 p -79.04 -10.44 59.83 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 114.277 -1.329 . . . . 1.18 109.942 178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.74 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 10.7 mtpt -87.34 -55.16 3.93 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.791 0.805 . . . . 1.02 109.763 166.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 11.3 t80 -49.95 -56.26 11.32 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 113.478 -1.692 . . . . 0.25 110.69 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 1.1 t70 -64.1 -35.96 82.48 Favored 'General case' 0 CA--C 1.494 -1.174 0 CA-C-O 122.868 1.318 . . . . 0.65 108.053 -171.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 32.0 t -62.11 -55.6 27.27 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 111.736 -2.484 . . . . 0.1 108.414 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.731 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.12 -37.26 85.27 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 112.891 -1.959 . . . . 0.04 108.842 -175.618 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.677 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -65.28 -35.23 80.39 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-N 113.235 -1.802 . . . . 0.07 109.898 178.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG22 ' A' ' 119' ' ' THR . 53.9 m -74.13 -39.15 63.5 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.555 -0.748 . . . . 0.07 110.808 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.72 ' HA ' HG21 ' A' ' 119' ' ' THR . 37.3 mt-30 -66.17 -40.12 90.25 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.315 -0.624 . . . . 0.09 109.315 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.752 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.05 -47.33 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.294 0 C-N-CA 118.043 -1.463 . . . . 0.06 109.461 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.3 OUTLIER -54.43 -32.0 56.48 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 120.956 0.408 . . . . 0.95 112.0 179.403 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.616 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.52 -48.46 72.42 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-N 115.368 -0.833 . . . . 0.05 110.203 173.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.5 mt -59.04 -45.49 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.593 0 CA-C-N 113.693 -1.594 . . . . 0.05 108.144 178.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.646 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.8 mt-30 -59.58 -49.61 77.1 Favored 'General case' 0 N--CA 1.41 -2.473 0 CA-C-N 114.091 -1.413 . . . . 0.09 108.148 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.545 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.2 OUTLIER -48.61 -57.05 6.81 Favored 'General case' 0 CA--C 1.493 -1.217 0 O-C-N 125.105 1.503 . . . . 0.4 110.617 -178.821 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -78.04 -38.64 24.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.33 -0.85 . . . . 0.05 110.206 -172.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.682 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 26.6 m-20 -58.18 -29.42 65.61 Favored 'General case' 0 CA--C 1.503 -0.845 0 CA-C-O 122.105 0.955 . . . . 0.09 109.855 171.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.8 -11.16 60.29 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 113.486 -1.688 . . . . 0.12 109.845 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.701 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.7 mm-40 -90.86 -18.98 23.9 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 114.033 -1.44 . . . . 0.25 109.162 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.708 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.0 m-85 -98.82 158.56 15.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.957 0.884 . . . . 0.12 111.771 175.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.678 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 13.2 mt-10 -63.75 -24.48 67.78 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 113.621 -1.627 . . . . 0.45 109.094 176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 10.1 ptmt -146.35 144.97 22.26 Favored Pre-proline 0 N--CA 1.443 -0.797 0 CA-C-N 113.999 -1.455 . . . . 2.94 109.026 174.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.682 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 82.7 Cg_exo -48.43 137.85 24.71 Favored 'Trans proline' 0 CA--C 1.488 -1.805 0 C-N-CA 124.173 3.249 . . . . 0.14 112.618 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.874 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.55 53.57 1.98 Allowed 'General case' 0 N--CA 1.407 -2.588 0 C-N-CA 116.714 -1.994 . . . . 0.06 111.501 172.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.78 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.6 mp -148.7 98.97 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.475 -1.924 0 N-CA-C 105.067 -2.198 . . . . 0.1 105.067 150.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.654 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 28.6 m -131.22 113.97 25.14 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.931 0 C-N-CA 119.111 -1.036 . . . . 0.14 109.546 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.69 ' C ' HG21 ' A' ' 37' ' ' THR . 26.5 t70 73.88 43.21 0.33 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 113.876 -1.511 . . . . 0.53 109.324 -172.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.076 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.56 3.13 18.78 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.383 -0.826 . . . . 0.1 113.037 179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.79 135.88 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 122.635 1.207 . . . . 0.15 110.528 179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.874 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.28 153.48 43.59 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-N 112.975 -1.92 . . . . 0.11 111.854 -175.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.489 ' HB2' ' HA ' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -106.1 94.61 5.26 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.782 -1.554 . . . . 0.48 107.502 176.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.86 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -69.06 -9.71 53.94 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-O 122.66 1.219 . . . . 0.2 109.57 -179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -84.99 -3.6 58.84 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 112.788 -2.006 . . . . 0.9 109.568 178.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.89 176.53 6.31 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.896 -1.502 . . . . 0.2 111.579 -178.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.678 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 21.6 mmmt -135.93 94.54 3.07 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.152 -1.385 . . . . 1.99 111.523 -169.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -63.46 99.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.372 -0.603 . . . . 0.13 109.372 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.643 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.9 mtmt -45.0 163.64 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 114.402 -1.272 . . . . 0.26 113.251 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.9 m -72.26 0.91 8.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.076 -0.966 . . . . 0.29 109.995 175.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.39 -14.13 11.62 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.403 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.701 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.83 116.05 1.11 Allowed 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 122.536 1.16 . . . . 0.15 111.968 174.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -134.59 100.71 4.72 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 112.765 -2.016 . . . . 2.22 108.174 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.695 ' CG ' HG23 ' A' ' 132' ' ' ILE . 84.2 m-85 -89.22 156.12 18.97 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 114.298 1.222 . . . . 0.15 114.298 -167.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 117' ' ' ILE . 0.7 OUTLIER -129.54 132.6 46.88 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 112.867 -1.97 . . . . 0.2 107.997 172.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -70.39 72.38 0.48 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 122.574 1.178 . . . . 1.36 108.566 176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.473 HG21 ' CB ' ' A' ' 84' ' ' ALA . 15.8 mt -70.27 119.91 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 CA-C-N 113.171 -1.831 . . . . 0.18 112.416 -172.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.402 ' HA ' ' CG ' ' A' ' 125' ' ' ASP . 70.7 mmtt -105.26 102.82 12.28 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.025 -1.443 . . . . 1.87 109.869 169.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.72 HG21 ' HA ' ' A' ' 81' ' ' GLN . 54.2 p -77.58 -13.0 60.02 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 112.839 -1.982 . . . . 0.16 108.467 174.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 93.66 -19.14 54.54 Favored Glycine 0 N--CA 1.426 -1.967 0 CA-C-N 114.151 -1.386 . . . . 0.18 110.818 -170.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.62 ' OD1' ' HA ' ' A' ' 42' ' ' THR . 53.9 t30 -89.23 86.37 6.84 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 107.958 -1.127 . . . . 0.45 107.958 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.862 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 34.5 m -48.52 -53.68 17.2 Favored 'General case' 0 C--O 1.198 -1.636 0 N-CA-C 113.691 0.997 . . . . 0.26 113.691 -173.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.791 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.2 mm-40 -53.83 -36.67 62.78 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 120.983 0.421 . . . . 1.66 110.425 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.784 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.7 tp -72.41 -45.25 60.52 Favored 'General case' 0 C--O 1.206 -1.218 0 CA-C-N 115.194 -0.912 . . . . 0.09 108.55 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 39.8 m-20 -55.95 -29.1 59.64 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 113.941 -1.481 . . . . 1.49 109.39 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.862 ' HG3' ' O ' ' A' ' 122' ' ' THR . 19.9 mtpp -82.88 -23.24 33.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.535 -1.212 . . . . 1.29 112.66 174.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 123' ' ' GLU . 43.5 t -91.96 -28.93 4.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 108.855 -0.795 . . . . 0.09 108.855 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.784 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.9 mt -55.42 -48.42 74.45 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 106.294 -1.743 . . . . 0.07 106.294 170.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.16 -48.41 78.77 Favored 'General case' 0 CA--C 1.495 -1.153 0 CA-C-N 110.628 -2.987 . . . . 0.37 111.82 179.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.623 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -44.05 -45.55 8.03 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 112.393 -2.185 . . . . 1.66 110.092 177.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.708 ' HB1' ' CE2' ' A' ' 92' ' ' PHE . . . -68.91 -51.8 36.15 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 113.818 -1.537 . . . . 0.06 109.718 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.695 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -52.14 -23.53 4.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-N 115.271 -0.877 . . . . 0.09 111.547 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 2.8 t -80.21 -17.03 53.43 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.185 -0.916 . . . . 1.33 109.584 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.86 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -80.44 -29.42 37.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.637 -1.165 . . . . 0.1 108.626 169.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.668 -1.073 . . . . 1.19 112.554 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.927 -0.469 . . . . 22.48 111.927 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 34.7 m80 56.42 43.27 26.37 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.404 0.621 . . . . 23.33 111.008 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.9 ttm -134.57 -32.13 1.03 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.297 -0.865 . . . . 22.11 109.665 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -91.83 62.23 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.508 0.671 . . . . 20.59 109.554 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.05 95.78 5.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.132 -0.692 . . . . 18.37 109.132 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.66 41.7 0.57 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.855 -0.611 . . . . 16.65 112.129 -171.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.1 ptp180 -91.11 -14.61 30.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.3 0.571 . . . . 17.53 109.569 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.419 ' HB2' ' H ' ' A' ' 11' ' ' GLU . 2.6 p -111.58 132.69 54.37 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.441 -0.799 . . . . 15.09 110.903 -178.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.8 t -83.92 -30.89 25.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.098 -0.501 . . . . 13.75 110.716 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -144.21 9.25 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 14.58 110.826 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' H ' ' HB2' ' A' ' 8' ' ' SER . 40.9 tt0 71.09 138.37 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.465 -0.789 . . . . 13.16 110.65 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 47.1 mm -73.07 103.35 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.091 -0.504 . . . . 10.1 110.427 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -127.81 -71.36 0.66 Allowed 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 116.111 -0.495 . . . . 10.66 110.613 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.6 m -102.57 83.83 2.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.507 0.67 . . . . 7.42 111.336 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 6.4 p -99.56 12.2 37.12 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.811 0.815 . . . . 6.06 108.943 172.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -101.83 133.69 46.19 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.703 -1.135 . . . . 6.06 110.845 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 m -67.95 -176.94 0.74 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.795 -0.639 . . . . 2.91 111.062 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.403 ' O ' ' HB3' ' A' ' 66' ' ' ARG . 11.4 p -49.68 133.13 21.59 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.919 0.39 . . . . 1.44 111.416 177.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.481 ' C ' ' HB3' ' A' ' 65' ' ' SER . 13.6 m -143.98 149.85 37.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.304 0.573 . . . . 1.25 111.061 -176.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -81.39 178.1 8.57 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 122.205 1.002 . . . . 0.39 112.146 -173.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 24' ' ' ASP . 13.1 m-80 -119.74 153.59 35.42 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.316 -1.766 . . . . 0.43 107.529 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.652 HE21 ' HB ' ' A' ' 25' ' ' VAL . 1.0 OUTLIER -76.79 -13.15 60.05 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 120.023 -0.671 . . . . 1.0 111.027 -179.056 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -80.34 -12.81 59.55 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 108.014 -1.106 . . . . 1.36 108.014 171.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.64 ' HB3' HD13 ' A' ' 62' ' ' LEU . 83.5 m-20 -97.38 -44.67 6.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 114.287 -1.324 . . . . 1.27 109.072 177.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.652 ' HB ' HE21 ' A' ' 22' ' ' GLN . 55.8 t -87.19 -53.19 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 113.434 -1.712 . . . . 1.01 112.994 -167.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 22' ' ' GLN . 25.1 t70 -56.78 -50.11 73.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.183 -0.462 . . . . 0.51 111.639 -173.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -67.39 -37.55 83.29 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 109.785 -0.45 . . . . 0.45 109.785 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE1' HD13 ' A' ' 55' ' ' LEU . 75.7 t80 -54.82 -63.03 1.28 Allowed 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 107.958 -1.127 . . . . 0.13 107.958 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.419 ' ND2' HG13 ' A' ' 25' ' ' VAL . 9.4 m-80 -56.91 -32.39 65.87 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.735 -1.575 . . . . 0.3 111.332 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.5 m -78.95 -46.64 17.93 Favored 'General case' 0 N--CA 1.422 -1.838 0 CA-C-N 115.582 -0.735 . . . . 0.2 111.166 -174.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.671 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 16.2 tp -69.2 -32.32 71.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 107.175 -1.416 . . . . 0.53 107.175 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.767 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 46.4 t80 -64.6 -47.91 76.86 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 113.349 -1.75 . . . . 0.15 110.556 176.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -26.05 68.38 Favored 'General case' 0 CA--C 1.501 -0.934 0 CA-C-O 122.402 1.096 . . . . 0.52 108.653 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.09 -33.82 61.67 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 112.823 -1.989 . . . . 0.1 111.59 -175.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.738 ' CG ' HD11 ' A' ' 78' ' ' LEU . 44.1 m-85 -62.59 -20.53 64.82 Favored 'General case' 0 CA--C 1.488 -1.43 0 N-CA-C 108.879 -0.785 . . . . 0.08 108.879 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.586 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 83.9 m-85 -95.91 128.14 42.54 Favored 'General case' 0 N--CA 1.42 -1.926 0 CA-C-N 114.708 -1.133 . . . . 0.11 109.489 176.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.5 p -61.72 -26.94 68.36 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 113.484 -1.689 . . . . 0.17 110.459 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.1 p30 -138.07 157.78 45.65 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.041 -0.981 . . . . 1.52 108.649 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.8 p -77.39 3.76 12.46 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.71 -0.396 . . . . 0.36 111.221 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -77.39 -18.92 56.9 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.642 -0.873 . . . . 1.15 108.642 169.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.709 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.2 mtpt 54.11 41.79 31.86 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 113.965 -1.471 . . . . 0.66 110.662 176.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.754 HG22 ' OE2' ' A' ' 123' ' ' GLU . 41.0 p -103.76 -5.68 22.23 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.602 -2.09 . . . . 0.21 109.494 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.137 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -151.9 144.55 24.26 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.165 -1.379 . . . . 0.1 109.447 -170.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.751 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -122.29 137.59 54.79 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 114.871 1.434 . . . . 0.09 114.871 -172.221 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.523 ' HG2' HG22 ' A' ' 37' ' ' THR . 2.3 mmmm -83.45 134.59 34.86 Favored 'General case' 0 CA--C 1.487 -1.466 0 CA-C-N 113.59 -1.641 . . . . 1.95 109.277 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -88.26 -24.34 23.25 Favored 'General case' 0 C--N 1.281 -2.377 0 CA-C-N 113.373 -1.74 . . . . 1.78 111.634 -164.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.5 t -73.4 -24.85 60.34 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.991 0.425 . . . . 1.32 110.206 176.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.522 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.9 mm100 -68.03 -24.64 65.12 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.298 -0.41 . . . . 0.82 111.244 178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.555 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 3.2 m-30 -54.79 -25.1 25.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.381 0.61 . . . . 0.13 111.116 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.56 -28.53 69.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.12 -0.945 . . . . 0.41 110.087 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.625 ' HB3' HD21 ' A' ' 31' ' ' LEU . 1.3 mmtm -98.17 8.64 44.5 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-N 113.849 -1.523 . . . . 1.47 110.677 -176.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.662 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -64.55 -38.08 89.76 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.901 -0.72 . . . . 0.09 111.036 178.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -69.5 -22.19 63.62 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.616 0.722 . . . . 1.25 109.22 172.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.667 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 4.2 tt0 -77.63 -38.52 47.73 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.82 -1.082 . . . . 1.24 110.209 175.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.74 -28.09 67.34 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 108.392 -0.966 . . . . 0.1 108.392 174.748 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.625 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 4.7 tptp -76.45 -30.84 57.51 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 114.806 -1.088 . . . . 0.82 108.532 173.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.689 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.7 OUTLIER -70.43 -39.93 74.1 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.508 -1.224 . . . . 0.14 109.661 178.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.747 ' O ' HD22 ' A' ' 62' ' ' LEU . 10.9 mt -72.15 -41.14 67.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.299 -0.864 . . . . 0.16 110.61 177.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.624 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.58 -37.08 82.54 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 109.317 -0.623 . . . . 0.11 109.317 169.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.71 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -62.81 -23.23 67.15 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.508 0.671 . . . . 0.66 110.002 172.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HG3' ' O ' ' A' ' 57' ' ' THR . 46.7 mttm -81.25 -20.25 41.37 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.126 -0.943 . . . . 1.92 109.82 174.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -87.13 -22.64 25.23 Favored 'General case' 0 CA--C 1.492 -1.287 0 CA-C-N 114.243 -1.344 . . . . 0.14 107.642 177.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.3 mt-10 -47.22 131.14 13.1 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 113.55 -1.659 . . . . 1.75 112.07 177.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.59 -10.6 69.05 Favored Glycine 0 N--CA 1.438 -1.206 0 CA-C-N 115.314 -0.857 . . . . 0.26 111.643 -178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.481 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.4 m -110.32 165.13 12.02 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.796 -0.446 . . . . 0.27 109.796 179.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 13.7 ptp180 -70.4 -30.95 67.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.19 0.519 . . . . 3.05 111.443 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.717 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 1.8 mm-40 -57.53 -38.36 74.57 Favored 'General case' 0 CA--C 1.494 -1.18 0 CA-C-N 115.122 -0.945 . . . . 2.51 109.426 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.673 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 29.8 t-80 -40.81 -46.52 2.72 Favored 'General case' 0 C--O 1.192 -1.923 0 CA-C-N 113.255 -1.793 . . . . 0.17 113.13 177.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 34.5 m -56.27 -52.71 63.5 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-O 123.07 1.414 . . . . 0.22 111.053 -178.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.714 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -67.63 -43.39 80.49 Favored 'General case' 0 N--CA 1.419 -1.995 0 CA-C-N 111.489 -2.596 . . . . 0.21 107.298 -173.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.555 ' HA ' ' HD3' ' A' ' 74' ' ' LYS . . . -81.95 -20.96 37.56 Favored 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 111.902 -2.408 . . . . 0.11 111.308 -173.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 26.5 tttt -75.41 -35.99 60.92 Favored 'General case' 0 CA--C 1.471 -2.077 0 N-CA-C 106.409 -1.7 . . . . 1.35 106.409 171.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' SER . 69.1 m -77.24 -15.77 59.32 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 113.551 -1.659 . . . . 1.18 110.268 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 2.7 mtpt -83.62 -54.9 4.6 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-O 122.205 1.002 . . . . 1.02 109.81 168.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.544 ' CE2' ' HB2' ' A' ' 56' ' ' LYS . 13.5 t80 -50.85 -56.24 13.18 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 113.004 -1.907 . . . . 0.25 110.768 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.7 OUTLIER -63.33 -35.93 82.03 Favored 'General case' 0 CA--C 1.496 -1.106 0 CA-C-O 123.045 1.402 . . . . 0.65 107.881 -170.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 34.7 t -63.03 -55.38 26.14 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 111.564 -2.562 . . . . 0.1 108.497 -179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.738 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.42 -36.86 83.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 113.051 -1.886 . . . . 0.04 109.112 -175.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.25 -34.33 77.76 Favored 'General case' 0 CA--C 1.491 -1.309 0 CA-C-N 113.312 -1.767 . . . . 0.07 110.31 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.446 HG22 HG22 ' A' ' 119' ' ' THR . 50.5 m -76.07 -37.68 57.95 Favored 'General case' 0 C--N 1.297 -1.697 0 CA-C-N 115.323 -0.853 . . . . 0.07 110.586 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' A' ' 119' ' ' THR . 42.1 mt-30 -66.32 -40.86 90.21 Favored 'General case' 0 N--CA 1.41 -2.466 0 N-CA-C 109.345 -0.613 . . . . 0.09 109.345 -177.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.751 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -74.87 -48.64 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.521 0 C-N-CA 117.883 -1.527 . . . . 0.06 109.328 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.7 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 8.2 mptt -51.42 -33.82 32.15 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 112.542 0.571 . . . . 0.95 112.542 178.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.611 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -64.96 -49.39 70.5 Favored 'General case' 0 CA--C 1.478 -1.82 0 CA-C-N 115.049 -0.978 . . . . 0.05 110.242 173.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.817 HG23 ' HB ' ' A' ' 97' ' ' ILE . 76.0 mt -59.07 -43.84 90.08 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.612 0 CA-C-N 113.611 -1.631 . . . . 0.05 108.209 178.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.58 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.4 -50.72 72.85 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-N 113.97 -1.468 . . . . 0.09 108.324 179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.9 OUTLIER -48.21 -57.79 5.43 Favored 'General case' 0 CA--C 1.492 -1.267 0 O-C-N 125.029 1.456 . . . . 0.4 110.226 -178.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.5 m -75.37 -40.79 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.05 110.18 -172.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.676 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 22.3 m-20 -58.4 -28.4 65.16 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 122.014 0.911 . . . . 0.09 109.948 172.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.25 -15.4 61.42 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 113.667 -1.606 . . . . 0.12 109.922 -176.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.719 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.4 mm-40 -88.36 -18.83 27.58 Favored 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 114.212 -1.358 . . . . 0.25 109.386 -179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.7 m-85 -97.97 158.02 15.78 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 122.18 0.991 . . . . 0.12 111.668 176.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.686 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 9.4 mt-10 -64.2 -24.6 67.73 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.228 -1.805 . . . . 0.45 109.378 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -145.1 142.8 18.87 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-N 114.304 -1.316 . . . . 2.94 107.667 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.676 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 90.3 Cg_exo -49.75 137.88 33.94 Favored 'Trans proline' 0 CA--C 1.488 -1.819 0 C-N-CA 123.886 3.058 . . . . 0.14 112.692 -175.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.893 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.77 53.45 1.97 Allowed 'General case' 0 N--CA 1.407 -2.594 0 C-N-CA 116.799 -1.96 . . . . 0.06 111.398 173.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.817 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.11 98.01 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.484 -1.561 0 N-CA-C 105.464 -2.051 . . . . 0.1 105.464 149.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.3 m -131.59 106.61 12.02 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.027 0 C-N-CA 119.045 -1.062 . . . . 0.14 109.624 -175.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 18.3 t70 81.44 42.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 112.893 -1.958 . . . . 0.53 109.321 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.137 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 65.75 4.57 20.37 Favored Glycine 0 CA--C 1.501 -0.789 0 CA-C-N 115.334 -0.848 . . . . 0.1 113.029 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 p -128.95 138.17 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.683 0 CA-C-O 122.407 1.098 . . . . 0.15 109.57 177.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.893 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.5 OUTLIER -67.76 155.1 40.06 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 113.095 -1.866 . . . . 0.11 111.552 -176.436 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.506 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.7 OUTLIER -107.62 94.58 5.16 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.164 -1.38 . . . . 0.48 107.537 175.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.831 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.5 p -67.61 -13.4 62.04 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 122.82 1.295 . . . . 0.2 109.52 -178.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -81.59 -5.15 57.76 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 112.482 -2.145 . . . . 0.9 109.713 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.651 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -73.3 177.49 5.13 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.66 -1.609 . . . . 0.2 111.267 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.686 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 19.8 mmmt -136.83 94.54 2.99 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 114.273 -1.33 . . . . 1.99 111.427 -169.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.517 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -62.42 102.8 0.34 Allowed 'General case' 0 C--N 1.31 -1.144 0 N-CA-C 108.776 -0.824 . . . . 0.13 108.776 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 43.7 mtmt -47.51 162.97 0.05 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.723 -1.126 . . . . 0.26 112.835 -177.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 m -71.5 1.11 6.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.29 110.501 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 109' ' ' LYS . 32.9 t70 -119.87 -11.55 9.32 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.843 -1.071 . . . . 1.51 109.203 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.719 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -45.24 119.16 1.95 Allowed 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 122.511 1.148 . . . . 0.15 111.447 171.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -135.86 101.4 4.74 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-N 113.046 -1.888 . . . . 2.22 108.413 179.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.696 ' CG ' HG23 ' A' ' 132' ' ' ILE . 87.1 m-85 -90.23 154.48 19.71 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 114.217 1.192 . . . . 0.15 114.217 -168.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -128.02 134.64 49.25 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 112.811 -1.995 . . . . 0.2 107.915 173.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.48 68.1 0.54 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.063 0.935 . . . . 1.36 109.022 177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.47 HG21 ' CB ' ' A' ' 84' ' ' ALA . 12.2 mt -66.88 122.82 18.64 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-N 113.278 -1.783 . . . . 0.18 112.187 -171.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HA ' ' OD1' ' A' ' 125' ' ' ASP . 33.2 mmtp -106.89 106.91 17.66 Favored 'General case' 0 CA--C 1.49 -1.347 0 CA-C-N 114.282 -1.326 . . . . 1.87 109.609 169.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.716 HG21 ' HA ' ' A' ' 81' ' ' GLN . 72.7 p -79.3 -16.31 56.58 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 112.708 -2.042 . . . . 0.16 108.616 174.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 96.24 -24.56 29.71 Favored Glycine 0 N--CA 1.426 -2.014 0 CA-C-N 113.941 -1.482 . . . . 0.18 110.844 -168.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.9 t-20 -83.1 88.45 6.89 Favored 'General case' 0 C--O 1.214 -0.808 0 N-CA-C 107.633 -1.247 . . . . 0.45 107.633 172.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.88 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 66.7 m -50.17 -52.06 38.57 Favored 'General case' 0 C--O 1.2 -1.537 0 N-CA-C 112.906 0.706 . . . . 0.26 112.906 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.754 ' OE2' HG22 ' A' ' 42' ' ' THR . 1.8 mp0 -54.01 -38.73 65.43 Favored 'General case' 0 C--N 1.289 -2.053 0 C-N-CA 123.963 0.905 . . . . 1.66 110.761 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.742 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 10.2 tp -74.06 -42.79 59.66 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 114.42 -1.264 . . . . 0.09 108.958 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.711 ' HB2' ' HA ' ' A' ' 122' ' ' THR . 16.7 m-20 -56.23 -31.5 63.59 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 114.14 -1.391 . . . . 1.49 108.983 178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.88 ' HG3' ' O ' ' A' ' 122' ' ' THR . 35.1 mtpt -82.15 -16.5 49.64 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.542 -1.208 . . . . 1.29 112.552 175.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 123' ' ' GLU . 30.8 t -96.64 -29.08 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 N-CA-C 109.055 -0.72 . . . . 0.09 109.055 176.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 60.5 mt -55.78 -48.39 75.41 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 106.201 -1.778 . . . . 0.07 106.201 171.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.14 -47.76 80.34 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 110.669 -2.969 . . . . 0.37 111.431 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.85 -44.12 14.03 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 112.166 -2.288 . . . . 1.66 110.169 178.699 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.716 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.56 -52.74 23.47 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 113.994 -1.457 . . . . 0.06 109.595 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.696 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.9 mt -51.24 -23.68 2.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.108 0 CA-C-N 115.285 -0.87 . . . . 0.09 111.558 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 38.2 m -82.45 -15.21 53.4 Favored 'General case' 0 N--CA 1.416 -2.141 0 CA-C-N 115.406 -0.816 . . . . 1.33 110.527 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.831 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.7 mp -79.62 -28.81 40.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.897 -1.047 . . . . 0.1 108.391 167.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.517 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.53 -1.15 . . . . 1.19 112.778 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.874 -0.491 . . . . 22.48 111.874 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -111.15 119.79 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.437 -0.579 . . . . 23.33 109.437 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.7 mmt 71.12 106.23 0.06 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.14 0.9 . . . . 22.11 110.186 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -55.79 148.24 17.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 20.59 111.189 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.7 m -73.87 60.65 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.744 -0.662 . . . . 18.37 112.215 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.96 27.71 1.14 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.305 0.574 . . . . 16.65 110.391 177.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 78.8 mtp180 -94.21 2.53 55.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.446 -0.797 . . . . 17.53 110.259 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.7 m -54.94 131.2 44.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.7 -0.682 . . . . 15.09 111.886 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.7 m 69.33 66.72 0.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.383 -0.826 . . . . 13.75 111.573 176.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 7' ' ' ARG . 72.9 mmtt -91.91 -22.92 19.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.821 -0.627 . . . . 14.58 109.687 172.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.84 173.55 6.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.443 -0.799 . . . . 13.16 109.017 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 59.2 mt -84.07 71.91 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.605 0.717 . . . . 10.1 110.318 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -140.7 143.47 35.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.429 -0.805 . . . . 10.66 109.913 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 9.8 m 64.38 11.81 6.78 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.52 0.676 . . . . 7.42 110.821 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.0 p -87.79 -7.13 57.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.09 -0.505 . . . . 6.06 111.468 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -70.25 -78.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.827 0.346 . . . . 6.06 110.445 178.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.4 m -157.93 76.3 0.79 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.417 -0.586 . . . . 2.91 109.417 177.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.0 p 57.8 164.92 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 124.276 0.985 . . . . 1.44 112.643 -177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.606 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 26.1 m -152.49 146.69 25.46 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.338 0.59 . . . . 1.25 110.428 177.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -80.34 179.5 7.65 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.213 1.006 . . . . 0.39 111.367 -176.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.561 ' O ' HG13 ' A' ' 25' ' ' VAL . 9.7 m-80 -117.12 144.16 45.0 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 106.216 -1.772 . . . . 0.43 106.216 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.635 HE21 HG22 ' A' ' 25' ' ' VAL . 1.2 mp0 -67.95 -15.0 63.41 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 119.437 1.017 . . . . 1.0 111.005 -178.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.7 p -78.72 -8.0 58.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 108.428 -0.953 . . . . 1.36 108.428 171.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 62' ' ' LEU . 78.2 m-20 -99.02 -49.54 4.48 Favored 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 114.44 -1.255 . . . . 1.27 108.475 174.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.635 HG22 HE21 ' A' ' 22' ' ' GLN . 1.9 m -89.51 -41.39 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.009 0 CA-C-N 114.768 -1.105 . . . . 1.01 113.133 -166.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -59.79 -48.98 79.51 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.693 -0.231 . . . . 0.51 110.655 -174.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.15 -39.44 89.83 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.727 -0.471 . . . . 0.45 109.727 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.643 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 63.8 t80 -52.59 -63.59 1.09 Allowed 'General case' 0 CA--C 1.496 -1.124 0 N-CA-C 108.168 -1.049 . . . . 0.13 108.168 175.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.593 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 12.2 m-80 -60.62 -28.25 68.39 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 113.13 -1.85 . . . . 0.3 111.452 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.6 m -77.99 -48.28 16.58 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.53 -0.759 . . . . 0.2 111.051 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.674 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 13.4 tp -66.89 -33.55 75.83 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 106.974 -1.491 . . . . 0.53 106.974 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.593 ' CE1' ' HB3' ' A' ' 74' ' ' LYS . 45.4 t80 -63.98 -47.81 78.91 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 112.768 -2.014 . . . . 0.15 110.828 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.3 -25.72 68.44 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-O 122.493 1.139 . . . . 0.52 108.714 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -77.85 -32.44 52.07 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.665 -2.062 . . . . 0.1 111.513 -174.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.737 ' CG ' HD11 ' A' ' 78' ' ' LEU . 36.6 m-85 -62.29 -21.5 65.28 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 109.035 -0.728 . . . . 0.08 109.035 176.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.613 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.5 m-85 -93.74 126.07 38.71 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 114.675 -1.148 . . . . 0.11 109.111 178.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.7 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.9 p -58.76 -25.29 62.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 113.451 -1.704 . . . . 0.17 110.733 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 7.8 p30 -149.62 155.68 40.67 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.344 -0.984 . . . . 1.52 108.344 178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 p -75.48 5.78 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.284 0.846 . . . . 0.36 113.284 -170.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.554 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 93.1 m-20 -78.7 -15.79 58.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 108.631 -0.877 . . . . 1.15 108.631 168.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.475 ' NZ ' ' HE2' ' A' ' 32' ' ' TYR . 9.1 mtpt 55.37 42.09 30.48 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.184 -1.371 . . . . 0.66 110.605 175.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.454 ' HA ' ' OD1' ' A' ' 121' ' ' ASN . 40.4 p -104.95 -1.72 25.48 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 112.428 -2.169 . . . . 0.21 109.828 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.074 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.09 149.94 26.66 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.398 -1.274 . . . . 0.1 109.337 -172.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.749 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -128.07 140.04 52.18 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 114.888 1.44 . . . . 0.09 114.888 -171.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HG3' HG22 ' A' ' 37' ' ' THR . 28.3 mttp -87.65 125.75 34.56 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.163 -1.835 . . . . 1.95 109.605 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.68 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 2.5 m120 -77.41 -25.85 51.16 Favored 'General case' 0 C--N 1.294 -1.806 0 CA-C-N 114.831 -1.077 . . . . 1.78 112.016 -171.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.3 t -66.66 -25.9 66.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.41 0.624 . . . . 1.32 109.928 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.525 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 9.9 mm100 -74.53 -23.22 58.78 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.57 -0.741 . . . . 0.82 111.107 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.519 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.1 m-30 -56.26 -23.51 36.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.13 111.284 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -71.25 -24.35 62.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.256 1.027 . . . . 0.41 109.052 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.647 ' CD ' HD11 ' A' ' 31' ' ' LEU . 3.1 mttt -99.37 9.92 42.39 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 113.953 -1.476 . . . . 1.47 110.218 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.648 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -68.27 -40.33 81.88 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 120.337 -0.545 . . . . 0.09 110.245 178.111 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -68.97 -16.72 63.8 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.643 0.735 . . . . 1.25 109.312 172.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.666 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.6 OUTLIER -84.64 -36.48 21.95 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.046 -0.979 . . . . 1.24 109.975 174.238 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -67.15 -27.24 67.13 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.148 -1.056 . . . . 0.1 108.148 175.141 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 56' ' ' LYS . 3.9 tptp -77.28 -31.23 54.71 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.468 -1.242 . . . . 0.82 108.446 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.67 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 0.6 OUTLIER -69.6 -40.75 76.47 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.672 -1.149 . . . . 0.14 110.02 178.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.756 ' O ' HD22 ' A' ' 62' ' ' LEU . 12.0 mt -71.27 -40.94 70.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.417 -0.81 . . . . 0.16 110.672 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.637 ' HA ' HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -61.74 -37.68 85.13 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.866 -0.791 . . . . 0.11 108.866 170.094 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -64.31 -19.24 65.31 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.64 0.733 . . . . 0.66 110.385 172.648 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 57' ' ' THR . 80.4 mttt -83.99 -20.66 32.45 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 122.029 0.919 . . . . 1.92 109.903 173.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.756 HD22 ' O ' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -86.14 -22.64 26.94 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-N 114.251 -1.341 . . . . 0.14 107.839 178.082 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.65 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 5.4 mt-10 -43.84 132.6 5.14 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.179 -1.828 . . . . 1.75 112.667 176.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.26 -14.69 57.01 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.151 -0.931 . . . . 0.26 111.601 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.552 ' HB3' ' C ' ' A' ' 19' ' ' THR . 1.2 m -109.33 161.56 15.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.192 -0.67 . . . . 0.27 109.192 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 29.8 ptt180 -65.9 -31.44 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.012 0.434 . . . . 3.05 111.544 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.69 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 2.8 mm-40 -56.12 -38.34 70.65 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 115.09 -0.959 . . . . 2.51 109.173 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 62' ' ' LEU . 26.2 t-80 -42.26 -45.88 4.32 Favored 'General case' 0 C--O 1.193 -1.869 0 CA-C-N 113.232 -1.803 . . . . 0.17 112.826 177.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.7 m -57.74 -53.9 53.01 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 122.927 1.346 . . . . 0.22 111.019 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.767 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -64.19 -45.17 89.53 Favored 'General case' 0 CA--C 1.475 -1.937 0 CA-C-N 111.623 -2.535 . . . . 0.21 107.251 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.454 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -80.71 -21.13 41.48 Favored 'General case' 0 N--CA 1.404 -2.735 0 CA-C-N 111.74 -2.482 . . . . 0.11 110.944 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.7 tttm -76.47 -34.49 58.69 Favored 'General case' 0 CA--C 1.476 -1.895 0 N-CA-C 106.431 -1.692 . . . . 1.35 106.431 172.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 77' ' ' SER . 24.1 m -76.9 -15.88 59.55 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.675 -1.602 . . . . 1.18 109.843 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 13.1 mtpp -85.64 -54.99 4.21 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.106 0.955 . . . . 1.02 109.812 169.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -50.47 -56.18 12.7 Favored 'General case' 0 N--CA 1.425 -1.689 0 CA-C-N 113.144 -1.844 . . . . 0.25 110.826 179.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.17 -35.67 81.07 Favored 'General case' 0 CA--C 1.497 -1.075 0 CA-C-O 122.951 1.358 . . . . 0.65 108.078 -170.843 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.61 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.0 t -63.14 -55.87 21.54 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 111.712 -2.495 . . . . 0.1 108.488 -179.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.737 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.8 OUTLIER -66.25 -36.86 84.1 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 113.074 -1.876 . . . . 0.04 109.17 -175.418 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.679 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.06 -34.62 78.48 Favored 'General case' 0 CA--C 1.49 -1.334 0 CA-C-N 113.391 -1.732 . . . . 0.07 110.068 179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.484 HG22 HG22 ' A' ' 119' ' ' THR . 49.7 m -75.94 -37.8 58.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.503 -0.771 . . . . 0.07 110.634 179.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.758 ' HA ' HG21 ' A' ' 119' ' ' THR . 40.3 mt-30 -67.05 -39.5 86.93 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.309 -0.626 . . . . 0.09 109.309 -177.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.749 HG22 HD22 ' A' ' 44' ' ' LEU . 1.4 pp -76.16 -47.29 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.403 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.26 175.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 0.2 OUTLIER -55.29 -30.93 61.14 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.09 0.472 . . . . 0.95 112.138 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.627 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.53 -49.42 69.0 Favored 'General case' 0 CA--C 1.479 -1.786 0 CA-C-N 115.178 -0.919 . . . . 0.05 110.164 172.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.3 mt -58.69 -44.35 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.535 0 CA-C-N 113.667 -1.606 . . . . 0.05 108.117 179.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.603 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.48 -51.37 70.17 Favored 'General case' 0 N--CA 1.408 -2.551 0 CA-C-N 113.899 -1.501 . . . . 0.09 108.311 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.553 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -48.06 -57.3 5.99 Favored 'General case' 0 CA--C 1.492 -1.277 0 O-C-N 124.909 1.381 . . . . 0.4 110.209 -178.363 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.627 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -75.77 -40.59 39.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.833 -1.076 . . . . 0.05 110.245 -172.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.684 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.9 m-20 -58.58 -29.08 66.14 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 122.11 0.957 . . . . 0.09 110.149 172.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -73.02 -15.13 61.53 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.469 -1.696 . . . . 0.12 109.703 -176.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.731 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 17.2 mm-40 -87.96 -20.1 26.35 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.077 -1.42 . . . . 0.25 109.493 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.698 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 29.2 m-85 -96.12 159.21 15.08 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.997 0.904 . . . . 0.12 111.626 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.704 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 12.8 mt-10 -64.73 -24.44 67.57 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.445 -1.707 . . . . 0.45 109.141 175.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -146.97 142.72 17.37 Favored Pre-proline 0 CA--C 1.513 -0.468 0 CA-C-N 114.321 -1.308 . . . . 2.94 108.594 173.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.684 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 77.9 Cg_exo -48.67 137.06 27.02 Favored 'Trans proline' 0 CA--C 1.486 -1.894 0 C-N-CA 124.093 3.195 . . . . 0.14 113.225 -174.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.903 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -131.0 53.51 1.97 Allowed 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 117.028 -1.869 . . . . 0.06 111.376 174.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.75 98.36 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.888 0 N-CA-C 104.852 -2.277 . . . . 0.1 104.852 149.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.68 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 24.1 m -129.99 111.82 22.4 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.86 0 C-N-CA 119.093 -1.043 . . . . 0.14 110.112 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.7 ' C ' HG21 ' A' ' 37' ' ' THR . 14.6 t70 72.3 46.12 0.33 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.389 -1.732 . . . . 0.53 109.165 -170.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.074 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 67.31 2.03 17.64 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.246 -0.888 . . . . 0.1 113.212 178.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -128.21 135.21 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 122.756 1.265 . . . . 0.15 110.757 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.903 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.6 OUTLIER -67.27 154.62 40.86 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 112.66 -2.064 . . . . 0.11 111.796 -176.321 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.496 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -108.41 95.13 5.45 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.9 -1.5 . . . . 0.48 108.053 174.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.837 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.4 p -67.92 -12.29 60.41 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 122.564 1.173 . . . . 0.2 109.82 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -2.2 55.7 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 112.972 -1.922 . . . . 0.9 109.309 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.605 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -75.47 175.64 8.29 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 113.941 -1.481 . . . . 0.2 111.367 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.704 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 18.2 mmmt -134.76 95.45 3.34 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.945 -1.48 . . . . 1.99 111.307 -169.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.86 102.4 0.35 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.7 -0.852 . . . . 0.13 108.7 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.591 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 45.4 mtmt -47.35 166.1 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 114.755 -1.111 . . . . 0.26 113.137 -176.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 m -72.4 0.25 10.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.605 -0.725 . . . . 0.29 110.384 174.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -115.2 -16.21 11.57 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-N 114.809 -1.087 . . . . 1.51 109.058 -177.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.731 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -44.78 114.83 0.77 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 122.545 1.164 . . . . 0.15 111.899 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -132.31 102.04 5.6 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 112.917 -1.947 . . . . 2.22 108.276 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.693 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.9 m-85 -89.65 155.65 19.09 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 122.338 1.066 . . . . 0.15 113.494 -169.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.1 p -128.77 136.71 50.91 Favored 'General case' 0 N--CA 1.432 -1.375 0 CA-C-N 113.033 -1.894 . . . . 0.2 107.915 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -69.54 67.92 0.23 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.964 0.888 . . . . 1.36 109.308 176.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.506 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -69.54 120.46 17.21 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 CA-C-N 113.443 -1.708 . . . . 0.18 111.784 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -111.59 105.73 14.37 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-N 114.362 -1.29 . . . . 1.87 110.513 170.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.758 HG21 ' HA ' ' A' ' 81' ' ' GLN . 66.6 p -76.44 -16.83 59.59 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 112.355 -2.202 . . . . 0.16 108.586 175.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 95.3 -16.51 61.13 Favored Glycine 0 N--CA 1.423 -2.208 0 CA-C-N 114.152 -1.385 . . . . 0.18 110.936 -170.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 124' ' ' LEU . 50.2 t30 -89.45 85.41 6.53 Favored 'General case' 0 C--O 1.215 -0.729 0 N-CA-C 109.248 -0.649 . . . . 0.45 109.248 176.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.864 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 61.3 m -45.84 -57.1 4.6 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 113.46 0.911 . . . . 0.26 113.46 -168.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.787 ' O ' HG23 ' A' ' 127' ' ' VAL . 3.7 mm-40 -53.03 -36.46 60.57 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 123.361 0.413 . . . . 1.66 110.571 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.765 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 14.8 tp -70.96 -45.45 64.09 Favored 'General case' 0 C--O 1.209 -1.078 0 CA-C-N 115.458 -0.792 . . . . 0.09 108.919 176.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.575 ' HA ' HD12 ' A' ' 128' ' ' LEU . 96.5 m-20 -57.0 -30.59 64.29 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.195 -0.911 . . . . 1.49 108.93 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.864 ' HG3' ' O ' ' A' ' 122' ' ' THR . 37.4 mtpt -78.42 -22.85 47.1 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.389 -1.278 . . . . 1.29 112.764 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -93.07 -29.79 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.915 -0.772 . . . . 0.09 108.915 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.765 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.5 mt -54.91 -48.56 72.91 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 106.446 -1.687 . . . . 0.07 106.446 171.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.3 OUTLIER -59.55 -45.65 91.18 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 110.597 -3.002 . . . . 0.37 111.504 -179.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.633 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.42 -44.16 17.01 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 112.672 -2.058 . . . . 1.66 110.043 177.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.699 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.87 -51.57 32.18 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.944 -1.48 . . . . 0.06 109.633 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.7 mt -53.02 -21.92 3.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.18 -0.918 . . . . 0.09 111.482 175.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 130' ' ' LYS . 1.3 t -78.26 -21.18 50.24 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.795 0.807 . . . . 1.33 109.473 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.837 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.5 mp -77.84 -28.71 50.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.57 -1.196 . . . . 0.1 108.852 170.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.829 -0.984 . . . . 1.19 112.381 177.536 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.802 -0.519 . . . . 22.48 111.802 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 71.4 t60 63.66 52.11 2.31 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.549 0.69 . . . . 23.33 110.354 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -86.17 55.29 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 22.11 110.148 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 4' ' ' GLN . 2.7 pt20 -140.98 152.06 44.64 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 20.59 110.073 -174.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.94 -22.36 2.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.688 0.28 . . . . 18.37 111.562 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -148.95 40.43 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.181 0.515 . . . . 16.65 110.478 -178.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 7' ' ' ARG . 16.2 tpt180 -77.72 -58.44 3.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.948 -0.569 . . . . 17.53 110.674 -178.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.2 m 53.61 75.41 0.26 Allowed 'General case' 0 C--O 1.232 0.179 0 O-C-N 123.639 0.587 . . . . 15.09 110.215 -176.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.1 m -67.26 88.83 0.19 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.844 -0.616 . . . . 13.75 111.095 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -121.38 111.22 17.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.523 -0.762 . . . . 14.58 109.428 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 45.3 mt-10 -60.18 116.12 3.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.51 -0.314 . . . . 13.16 110.909 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.484 HD12 ' H ' ' A' ' 12' ' ' ILE . 3.9 mp -73.28 110.07 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 109.735 -0.468 . . . . 10.1 109.735 174.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 15.5 mt-10 -124.01 -57.61 1.6 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.589 -0.732 . . . . 10.66 110.309 -175.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.3 m -84.01 129.32 34.92 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.425 -0.807 . . . . 7.42 109.569 176.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.1 p -53.8 119.13 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 123.376 0.422 . . . . 6.06 110.563 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -78.19 144.16 36.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.607 0.717 . . . . 6.06 112.379 -172.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.9 t -149.57 144.12 26.02 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.707 -1.133 . . . . 2.91 108.158 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 65' ' ' SER . 55.6 p 47.79 -92.6 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 124.075 0.86 . . . . 1.44 111.933 -178.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.649 ' HA ' ' HG2' ' A' ' 66' ' ' ARG . 14.5 m 71.84 150.78 0.1 Allowed 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.484 -1.235 . . . . 1.25 111.978 177.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.845 ' HB2' ' HB2' ' A' ' 67' ' ' GLU . . . -91.54 -171.43 2.91 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-N 114.224 -1.353 . . . . 0.39 112.375 -167.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.423 ' O ' HG23 ' A' ' 25' ' ' VAL . 4.8 m-80 -108.55 131.47 54.81 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 105.749 -1.945 . . . . 0.43 105.749 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.757 ' NE2' ' HB ' ' A' ' 25' ' ' VAL . 1.1 mp0 -70.21 -11.39 60.86 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.089 -0.644 . . . . 1.0 109.343 177.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 p -80.09 -8.67 59.51 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 115.141 -0.936 . . . . 1.36 108.677 171.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.653 ' OD2' ' HB2' ' A' ' 61' ' ' LYS . 18.3 t70 -97.08 -59.82 1.71 Allowed 'General case' 0 N--CA 1.416 -2.127 0 CA-C-O 123.225 1.488 . . . . 1.27 110.392 165.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.757 ' HB ' ' NE2' ' A' ' 22' ' ' GLN . 54.1 t -61.46 -42.72 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.594 0 CA-C-N 110.918 -2.856 . . . . 1.01 111.134 -156.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.74 -52.33 62.86 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.682 -1.145 . . . . 0.51 111.241 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -70.81 -38.03 73.28 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 110.527 -0.175 . . . . 0.45 110.527 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.647 ' HE2' ' HD3' ' A' ' 74' ' ' LYS . 43.0 t80 -52.69 -61.88 2.0 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 107.392 -1.336 . . . . 0.13 107.392 174.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.597 ' OD1' ' HE2' ' A' ' 74' ' ' LYS . 9.6 m-80 -59.84 -27.36 66.57 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.543 -1.662 . . . . 0.3 111.794 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 m -81.86 -44.13 17.29 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-N 115.989 -0.55 . . . . 0.2 110.953 -175.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.701 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 17.5 tp -70.4 -32.34 69.94 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.129 -1.434 . . . . 0.53 107.129 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.745 ' HE2' ' HZ1' ' A' ' 41' ' ' LYS . 35.6 t80 -65.18 -47.37 77.21 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 112.902 -1.954 . . . . 0.15 110.735 175.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.55 -25.25 68.16 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 122.486 1.136 . . . . 0.52 108.666 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 31' ' ' LEU . . . -75.42 -34.78 61.04 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 112.791 -2.004 . . . . 0.1 111.275 -175.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.759 ' CG ' HD11 ' A' ' 78' ' ' LEU . 42.1 m-85 -61.77 -20.33 63.46 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 109.235 -0.654 . . . . 0.08 109.235 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.628 ' CZ ' HD23 ' A' ' 78' ' ' LEU . 84.3 m-85 -95.22 127.06 40.97 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-N 114.753 -1.112 . . . . 0.11 109.165 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.698 HG21 ' C ' ' A' ' 99' ' ' ASP . 7.4 p -60.13 -26.68 66.45 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 113.438 -1.71 . . . . 0.17 110.454 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 40' ' ' ASN . 8.8 p30 -146.2 154.74 42.09 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.151 -1.055 . . . . 1.52 108.151 -178.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.8 p -74.8 -0.32 17.93 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.715 0.635 . . . . 0.36 112.715 -170.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.522 ' HB2' ' OD1' ' A' ' 38' ' ' ASN . 47.9 m-80 -76.85 -14.16 59.92 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.95 -0.759 . . . . 1.15 108.95 170.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.745 ' HZ1' ' HE2' ' A' ' 32' ' ' TYR . 8.7 mtpt 55.19 40.99 31.88 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 114.205 -1.361 . . . . 0.66 110.652 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 45.1 p -104.85 0.19 27.78 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 112.642 -2.072 . . . . 0.21 109.753 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.079 ' HB1' ' HA3' ' A' ' 100' ' ' GLY . . . -155.47 147.91 23.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 114.282 -1.326 . . . . 0.1 109.252 -172.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.716 HD22 HG22 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -125.83 141.6 51.91 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 114.52 1.304 . . . . 0.09 114.52 -172.062 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HG2' HG22 ' A' ' 37' ' ' THR . 1.6 mmmm -90.92 133.07 35.54 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 113.638 -1.619 . . . . 1.95 109.842 178.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.906 ' OD1' ' HA ' ' A' ' 98' ' ' VAL . 10.2 m120 -85.65 -20.8 28.9 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 113.917 -1.492 . . . . 1.78 111.93 -167.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 16.4 p -70.18 -27.24 64.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.388 0.613 . . . . 1.32 110.056 175.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.541 ' HG3' ' HA ' ' A' ' 35' ' ' PHE . 13.7 mm100 -72.75 -24.68 60.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.404 -0.816 . . . . 0.82 111.532 -179.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HD1' ' NE2' ' A' ' 86' ' ' GLN . 4.0 m-30 -54.49 -26.28 30.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.771 0.319 . . . . 0.13 111.401 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -24.71 64.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.829 0.823 . . . . 0.41 109.735 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.633 ' HD2' HD11 ' A' ' 31' ' ' LEU . 4.6 mmtt -96.34 7.08 47.38 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.381 -1.281 . . . . 1.47 110.393 -178.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.632 ' HG ' HG12 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -66.14 -37.18 85.07 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.204 -0.598 . . . . 0.09 110.474 178.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.0 p -70.6 -20.01 62.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.27 -0.641 . . . . 1.25 109.27 172.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.711 ' HA ' ' HB ' ' A' ' 57' ' ' THR . 0.1 OUTLIER -80.45 -37.77 31.32 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.271 -0.877 . . . . 1.24 110.018 174.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -68.5 -26.17 65.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 N-CA-C 108.397 -0.964 . . . . 0.1 108.397 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 60' ' ' ASP . 5.5 tptp -80.44 -23.26 40.41 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 114.583 -1.189 . . . . 0.82 108.766 173.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.711 ' HB ' ' HA ' ' A' ' 54' ' ' GLN . 0.6 OUTLIER -78.35 -41.9 32.09 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.774 -1.557 . . . . 0.14 109.799 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.645 ' O ' HD22 ' A' ' 62' ' ' LEU . 13.4 mt -69.77 -42.69 73.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 115.568 -0.742 . . . . 0.16 109.435 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.586 ' O ' ' HD2' ' A' ' 68' ' ' HIS . 0.3 OUTLIER -60.02 -35.26 74.69 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.458 -0.571 . . . . 0.11 109.458 171.139 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.808 ' O ' ' HB2' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -64.04 -25.2 68.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.074 0.94 . . . . 0.66 109.644 174.009 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.653 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 28.8 mttm -91.85 -6.88 50.81 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.558 -1.201 . . . . 1.92 110.29 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.7 HD11 HG22 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -92.65 -24.89 18.5 Favored 'General case' 0 CA--C 1.496 -1.131 0 CA-C-N 113.661 -1.609 . . . . 0.14 107.369 169.199 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.808 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 10.7 mt-10 -45.84 131.03 9.55 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.931 -1.486 . . . . 1.75 111.839 174.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.25 -9.28 73.54 Favored Glycine 0 N--CA 1.44 -1.067 0 CA-C-N 115.444 -0.798 . . . . 0.26 111.259 -176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.621 ' HB3' ' C ' ' A' ' 19' ' ' THR . 5.2 m -109.25 170.78 7.84 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.294 -0.632 . . . . 0.27 109.294 178.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' A' ' 19' ' ' THR . 0.5 OUTLIER -81.98 -25.25 34.94 Favored 'General case' 0 CA--C 1.511 -0.53 0 C-N-CA 120.25 -0.58 . . . . 3.05 110.526 178.13 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.845 ' HB2' ' HB2' ' A' ' 20' ' ' ALA . 3.3 mm-40 -58.75 -38.54 78.63 Favored 'General case' 0 CA--C 1.482 -1.665 0 CA-C-N 115.494 -0.775 . . . . 2.51 109.593 177.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.695 ' HB2' ' O ' ' A' ' 62' ' ' LEU . 35.9 t-80 -39.36 -43.77 1.23 Allowed 'General case' 0 C--O 1.19 -2.075 0 O-C-N 124.928 1.393 . . . . 0.17 112.62 175.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.5 m -60.45 -54.75 41.73 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 122.913 1.34 . . . . 0.22 111.147 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.805 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -65.15 -43.7 90.97 Favored 'General case' 0 CA--C 1.476 -1.881 0 CA-C-N 111.999 -2.364 . . . . 0.21 107.34 -175.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.432 ' N ' HD13 ' A' ' 70' ' ' LEU . . . -82.77 -20.26 36.2 Favored 'General case' 0 N--CA 1.403 -2.779 0 CA-C-N 111.783 -2.462 . . . . 0.11 110.892 -172.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.626 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 14.6 tttm -76.78 -34.6 57.99 Favored 'General case' 0 CA--C 1.474 -1.947 0 N-CA-C 106.226 -1.768 . . . . 1.35 106.226 170.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 77' ' ' SER . 34.9 t -75.82 -17.27 59.91 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 113.699 -1.592 . . . . 1.18 109.518 178.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.805 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 16.8 mtpp -85.5 -54.57 4.48 Favored 'General case' 0 CA--C 1.488 -1.44 0 CA-C-O 122.017 0.913 . . . . 1.02 109.856 169.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.424 ' HB3' ' HA ' ' A' ' 72' ' ' LYS . 14.2 t80 -51.46 -55.77 16.95 Favored 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.312 -1.767 . . . . 0.25 110.846 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.626 ' HB2' ' O ' ' A' ' 72' ' ' LYS . 0.5 OUTLIER -63.12 -35.98 82.09 Favored 'General case' 0 CA--C 1.495 -1.165 0 CA-C-O 123.007 1.384 . . . . 0.65 108.172 -171.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.595 ' HB3' ' O ' ' A' ' 74' ' ' LYS . 31.3 t -62.65 -55.9 22.69 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-N 111.841 -2.436 . . . . 0.1 108.334 -179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.759 HD11 ' CG ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -66.79 -37.53 84.75 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.034 -1.894 . . . . 0.04 109.379 -175.01 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.69 ' O ' ' HB2' ' A' ' 83' ' ' LYS . . . -66.09 -34.96 79.26 Favored 'General case' 0 CA--C 1.489 -1.388 0 CA-C-N 113.458 -1.701 . . . . 0.07 110.148 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 HG22 ' A' ' 119' ' ' THR . 40.4 m -76.97 -36.82 56.2 Favored 'General case' 0 C--N 1.297 -1.689 0 CA-C-N 115.34 -0.846 . . . . 0.07 110.654 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.718 ' HA ' HG21 ' A' ' 119' ' ' THR . 48.5 mt-30 -66.27 -40.13 89.9 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 109.277 -0.638 . . . . 0.09 109.277 -178.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.716 HG22 HD22 ' A' ' 44' ' ' LEU . 1.5 pp -75.56 -48.96 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 C-N-CA 118.026 -1.47 . . . . 0.06 109.536 174.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.69 ' HB2' ' O ' ' A' ' 79' ' ' ALA . 7.0 mptt -51.32 -33.15 27.91 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 112.625 0.602 . . . . 0.95 112.625 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.635 ' O ' HG13 ' A' ' 88' ' ' VAL . . . -65.33 -49.85 67.85 Favored 'General case' 0 CA--C 1.478 -1.793 0 CA-C-N 115.132 -0.94 . . . . 0.05 110.111 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.798 HG23 ' HB ' ' A' ' 97' ' ' ILE . 73.6 mt -58.59 -44.13 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.647 0 CA-C-N 113.498 -1.683 . . . . 0.05 108.161 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.596 ' HG3' HD12 ' A' ' 82' ' ' ILE . 1.7 mt-30 -59.18 -52.22 66.62 Favored 'General case' 0 N--CA 1.407 -2.613 0 CA-C-N 113.993 -1.458 . . . . 0.09 108.232 178.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -48.34 -55.72 9.97 Favored 'General case' 0 CA--C 1.491 -1.316 0 O-C-N 125.017 1.448 . . . . 0.4 110.331 -177.417 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 84' ' ' ALA . 1.4 m -77.15 -40.46 29.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.712 0 CA-C-N 115.067 -0.97 . . . . 0.05 110.276 -173.274 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.688 ' ND2' ' HB3' ' A' ' 95' ' ' PRO . 23.4 m-20 -57.86 -29.64 65.16 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.003 0.906 . . . . 0.09 109.857 172.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 87' ' ' ASP . . . -74.37 -10.91 60.04 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 113.417 -1.719 . . . . 0.12 109.776 -176.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.734 ' HB3' ' CB ' ' A' ' 112' ' ' ALA . 16.8 mm-40 -92.76 -16.55 25.28 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.291 -1.322 . . . . 0.25 109.393 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.694 ' CE2' ' HB1' ' A' ' 131' ' ' ALA . 26.8 m-85 -99.98 158.54 15.75 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 122.145 0.974 . . . . 0.12 111.537 174.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.691 ' HG3' ' HB3' ' A' ' 107' ' ' LYS . 15.8 mt-10 -65.46 -25.19 67.39 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-N 113.401 -1.727 . . . . 0.45 109.122 176.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -141.78 143.19 27.96 Favored Pre-proline 0 CA--C 1.512 -0.517 0 CA-C-N 114.371 -1.286 . . . . 2.94 107.763 173.878 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.688 ' HB3' ' ND2' ' A' ' 89' ' ' ASN . 85.1 Cg_exo -49.94 137.0 36.43 Favored 'Trans proline' 0 CA--C 1.488 -1.82 0 C-N-CA 123.868 3.045 . . . . 0.14 112.602 -176.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.882 ' HB1' HD12 ' A' ' 102' ' ' LEU . . . -130.86 54.13 1.92 Allowed 'General case' 0 N--CA 1.409 -2.521 0 C-N-CA 116.675 -2.01 . . . . 0.06 111.333 174.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.798 ' HB ' HG23 ' A' ' 85' ' ' ILE . 1.5 mp -148.15 98.97 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.476 -1.889 0 N-CA-C 104.821 -2.289 . . . . 0.1 104.821 149.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.906 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 22.6 m -133.09 111.87 17.22 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.864 0 C-N-CA 119.074 -1.05 . . . . 0.14 110.256 -175.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.698 ' C ' HG21 ' A' ' 37' ' ' THR . 33.5 t70 76.24 40.96 0.23 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.673 -1.603 . . . . 0.53 109.355 -170.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 1.079 ' HA3' ' HB1' ' A' ' 43' ' ' ALA . . . 66.93 4.87 29.63 Favored Glycine 0 CA--C 1.504 -0.647 0 CA-C-N 115.43 -0.805 . . . . 0.1 112.927 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.9 p -129.35 135.98 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-O 122.413 1.101 . . . . 0.15 110.025 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.882 HD12 ' HB1' ' A' ' 96' ' ' ALA . 0.4 OUTLIER -67.1 154.47 41.14 Favored 'General case' 0 C--N 1.287 -2.146 0 CA-C-N 113.212 -1.813 . . . . 0.11 111.472 -176.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.504 ' H ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -109.43 95.6 5.73 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 113.954 -1.476 . . . . 0.48 108.086 175.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.858 ' HA ' HD21 ' A' ' 134' ' ' LEU . 1.3 p -66.94 -13.0 61.33 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 122.7 1.238 . . . . 0.2 109.863 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -76.15 -12.39 60.1 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 112.594 -2.094 . . . . 0.9 109.768 178.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.653 ' CB ' ' HB2' ' A' ' 96' ' ' ALA . . . -70.04 174.32 5.53 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 113.389 -1.732 . . . . 0.2 111.477 -175.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.691 ' HB3' ' HG3' ' A' ' 93' ' ' GLU . 5.5 mmmm -133.29 95.95 3.63 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 113.926 -1.488 . . . . 1.99 111.624 -168.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.587 ' CB ' ' HA2' ' A' ' 135' ' ' GLY . . . -64.79 101.54 0.49 Allowed 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 109.158 -0.682 . . . . 0.13 109.158 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 92' ' ' PHE . 47.3 mtmt -45.27 160.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.261 -1.336 . . . . 0.26 113.01 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.8 m -70.27 0.88 5.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.454 -0.793 . . . . 0.29 110.807 176.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 109' ' ' LYS . 20.0 t70 -117.82 -16.08 10.0 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.068 -0.969 . . . . 1.51 109.112 -176.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.734 ' CB ' ' HB3' ' A' ' 91' ' ' GLN . . . -40.29 117.83 0.84 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 122.527 1.156 . . . . 0.15 112.125 173.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -134.39 100.85 4.79 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.792 -2.004 . . . . 2.22 108.404 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.714 ' CG ' HG23 ' A' ' 132' ' ' ILE . 86.6 m-85 -89.94 159.71 16.78 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 113.659 0.985 . . . . 0.15 113.659 -169.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -133.49 139.87 46.92 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.804 -1.544 . . . . 0.2 108.714 173.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.26 70.06 0.39 Allowed 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.115 -0.948 . . . . 1.36 108.64 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.497 HG21 ' CB ' ' A' ' 84' ' ' ALA . 10.7 mt -73.34 117.35 16.94 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-N 113.84 -1.527 . . . . 0.18 112.614 -169.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.477 ' HD3' ' OD2' ' A' ' 125' ' ' ASP . 55.3 mmtt -106.05 104.95 14.77 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 122.849 1.309 . . . . 1.87 109.974 171.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' HA ' ' A' ' 81' ' ' GLN . 51.6 p -77.81 -10.56 59.62 Favored 'General case' 0 C--N 1.285 -2.201 0 CA-C-N 112.205 -2.27 . . . . 0.16 109.159 175.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 92.92 -17.64 57.64 Favored Glycine 0 N--CA 1.429 -1.815 0 CA-C-N 114.354 -1.293 . . . . 0.18 111.093 -168.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 124' ' ' LEU . 59.2 t-20 -89.49 108.62 19.75 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.835 -1.172 . . . . 0.45 107.835 174.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 126' ' ' LYS . 33.1 m -64.87 -58.08 7.14 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 112.244 0.461 . . . . 0.26 112.244 -175.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.795 ' O ' HG23 ' A' ' 127' ' ' VAL . 1.5 mm-40 -53.1 -34.84 58.44 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.284 0.365 . . . . 1.66 110.218 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.804 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 24.3 tp -70.79 -45.23 65.06 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 115.651 -0.704 . . . . 0.09 109.518 176.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 16.5 t70 -51.9 -39.85 59.74 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-O 122.303 1.049 . . . . 1.49 108.621 176.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 122' ' ' THR . 25.7 mttm -72.1 -22.77 61.3 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-N 113.202 -1.817 . . . . 1.29 112.639 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 123' ' ' GLU . 32.6 t -94.41 -29.68 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.871 -0.789 . . . . 0.09 108.871 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.804 ' HG ' ' O ' ' A' ' 124' ' ' LEU . 59.8 mt -56.36 -48.83 76.0 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 106.15 -1.796 . . . . 0.07 106.15 171.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 125' ' ' ASP . 0.4 OUTLIER -57.06 -47.45 80.95 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-N 110.788 -2.915 . . . . 0.37 111.333 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -45.93 -45.09 15.23 Favored 'General case' 0 CA--C 1.491 -1.298 0 CA-C-N 112.382 -2.19 . . . . 1.66 109.961 178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.71 ' HA ' HD13 ' A' ' 102' ' ' LEU . . . -69.35 -52.09 30.58 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.71 -1.587 . . . . 0.06 109.531 -179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.714 HG23 ' CG ' ' A' ' 114' ' ' PHE . 1.8 mt -52.26 -23.45 4.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.367 -0.833 . . . . 0.09 111.333 176.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 1.3 t -78.62 -18.38 54.6 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-O 121.844 0.83 . . . . 1.33 109.781 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.858 HD21 ' HA ' ' A' ' 104' ' ' THR . 7.9 mp -79.98 -28.76 39.49 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.853 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.587 ' HA2' ' CB ' ' A' ' 108' ' ' ALA . . . . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.801 -0.999 . . . . 1.19 112.864 179.278 . . . . . . . . 1 1 . 1 stop_ save_